Input buildinfo: https://buildinfos.debian.net/buildinfo-pool/c/cp2k/cp2k_8.1-9_all.buildinfo Use metasnap for getting required timestamps New buildinfo file: /tmp/cp2k-8.1-9wpohlici/cp2k_8.1-9_all.buildinfo Get source package info: cp2k=8.1-9 Source URL: http://snapshot.notset.fr/mr/package/cp2k/8.1-9/srcfiles?fileinfo=1 env -i PATH=/usr/sbin:/usr/bin:/sbin:/bin TMPDIR=/tmp mmdebstrap --arch=amd64 --include=adduser=3.118 autoconf=2.69-14 automake=1:1.16.3-2 autopoint=0.21-4 autotools-dev=20180224.1+nmu1 base-files=11 base-passwd=3.5.49 bash=5.1-2+b1 bc=1.07.1-2+b2 binutils=2.35.2-2 binutils-common=2.35.2-2 binutils-x86-64-linux-gnu=2.35.2-2 bison=2:3.7.5+dfsg-1 bsdextrautils=2.36.1-7 bsdutils=1:2.36.1-7 build-essential=12.9 bzip2=1.0.8-4 ca-certificates=20210119 ca-certificates-java=20190909 coreutils=8.32-4+b1 cpp=4:10.2.1-1 cpp-10=10.2.1-6 dash=0.5.11+git20210120+802ebd4-1 debconf=1.5.76 debhelper=13.3.4 debianutils=4.11.2 default-jre-headless=2:1.11-72 dh-autoreconf=20 dh-strip-nondeterminism=1.11.0-1 diffutils=1:3.7-5 dpkg=1.20.7.1 dpkg-dev=1.20.7.1 dwz=0.14-1 file=1:5.39-3 findutils=4.8.0-1 flex=2.6.4-8 fontconfig-config=2.13.1-4.2 fonts-dejavu-core=2.37-2 g++=4:10.2.1-1 g++-10=10.2.1-6 gcc=4:10.2.1-1 gcc-10=10.2.1-6 gcc-10-base=10.2.1-6 gettext=0.21-4 gettext-base=0.21-4 gfortran=4:10.2.1-1 gfortran-10=10.2.1-6 grep=3.6-1 groff-base=1.22.4-6 gzip=1.10-4 hostname=3.23 ibverbs-providers=33.1-1 init-system-helpers=1.60 intltool-debian=0.35.0+20060710.5 java-common=0.72 libacl1=2.2.53-10 libarchive-zip-perl=1.68-1 libasan6=10.2.1-6 libasound2=1.2.4-1.1 libasound2-data=1.2.4-1.1 libatomic1=10.2.1-6 libattr1=1:2.4.48-6 libaudit-common=1:3.0-2 libaudit1=1:3.0-2 libavahi-client3=0.8-5 libavahi-common-data=0.8-5 libavahi-common3=0.8-5 libbinutils=2.35.2-2 libblas-dev=3.9.0-3 libblas3=3.9.0-3 libblkid1=2.36.1-7 libbrotli1=1.0.9-2+b2 libbsd0=0.11.3-1 libbz2-1.0=1.0.8-4 libc-bin=2.31-10 libc-dev-bin=2.31-10 libc6=2.31-10 libc6-dev=2.31-10 libcap-ng0=0.7.9-2.2+b1 libcbor0=0.5.0+dfsg-2 libcc1-0=10.2.1-6 libcom-err2=1.46.2-1 libcrypt-dev=1:4.4.18-1 libcrypt1=1:4.4.18-1 libctf-nobfd0=2.35.2-2 libctf0=2.35.2-2 libcups2=2.3.3op2-3 libdb5.3=5.3.28+dfsg1-0.8 libdbus-1-3=1.12.20-2 libdebconfclient0=0.257 libdebhelper-perl=13.3.4 libdom4j-java=2.1.3-1 libdpkg-perl=1.20.7.1 libedit2=3.1-20191231-2+b1 libelf1=0.183-3 libelpa-dev=2019.11.001-4 libelpa15=2019.11.001-4 libevent-2.1-7=2.1.12-stable-1 libevent-core-2.1-7=2.1.12-stable-1 libevent-dev=2.1.12-stable-1 libevent-extra-2.1-7=2.1.12-stable-1 libevent-openssl-2.1-7=2.1.12-stable-1 libevent-pthreads-2.1-7=2.1.12-stable-1 libexpat1=2.2.10-2 libfabric1=1.11.0-2 libffi7=3.3-6 libfftw3-bin=3.3.8-2 libfftw3-dev=3.3.8-2 libfftw3-double3=3.3.8-2 libfftw3-long3=3.3.8-2 libfftw3-quad3=3.3.8-2 libfftw3-single3=3.3.8-2 libfido2-1=1.6.0-2 libfile-stripnondeterminism-perl=1.11.0-1 libfontconfig1=2.13.1-4.2 libfreetype6=2.10.4+dfsg-1 libgcc-10-dev=10.2.1-6 libgcc-s1=10.2.1-6 libgcrypt20=1.8.7-3 libgdbm-compat4=1.19-2 libgdbm6=1.19-2 libgfortran-10-dev=10.2.1-6 libgfortran5=10.2.1-6 libglib2.0-0=2.66.8-1 libgmp10=2:6.2.1+dfsg-1 libgnutls30=3.7.1-1 libgomp1=10.2.1-6 libgpg-error0=1.38-2 libgraphite2-3=1.3.14-1 libgssapi-krb5-2=1.18.3-4 libharfbuzz0b=2.7.4-1 libhogweed6=3.7-2.1 libhwloc-dev=2.4.1+dfsg-1 libhwloc-plugins=2.4.1+dfsg-1 libhwloc15=2.4.1+dfsg-1 libibverbs-dev=33.1-1 libibverbs1=33.1-1 libicu67=67.1-6 libidn2-0=2.3.0-5 libint2-2=2.6.0-13 libint2-dev=2.6.0-13 libisl23=0.23-1 libitm1=10.2.1-6 libjaxen-java=1.1.6-4 libjdom1-java=1.1.3-2 libjpeg62-turbo=1:2.0.6-4 libjs-jquery=3.5.1+dfsg+~3.5.5-7 libjs-jquery-ui=1.12.1+dfsg-8 libk5crypto3=1.18.3-4 libkeyutils1=1.6.1-2 libkrb5-3=1.18.3-4 libkrb5support0=1.18.3-4 liblapack-dev=3.9.0-3 liblapack3=3.9.0-3 liblcms2-2=2.12~rc1-2 liblsan0=10.2.1-6 libltdl-dev=2.4.6-15 libltdl7=2.4.6-15 liblz4-1=1.9.3-1 liblzma5=5.2.5-2 libmagic-mgc=1:5.39-3 libmagic1=1:5.39-3 libmd0=1.0.3-3 libmount1=2.36.1-7 libmpc3=1.2.0-1 libmpdec3=2.5.1-1 libmpfr6=4.1.0-3 libncurses6=6.2+20201114-2 libncursesw6=6.2+20201114-2 libnettle8=3.7-2.1 libnl-3-200=3.4.0-1+b1 libnl-3-dev=3.4.0-1+b1 libnl-route-3-200=3.4.0-1+b1 libnl-route-3-dev=3.4.0-1+b1 libnsl-dev=1.3.0-2 libnsl2=1.3.0-2 libnspr4=2:4.29-1 libnss3=2:3.61-1 libnuma-dev=2.0.12-1+b1 libnuma1=2.0.12-1+b1 libopenmpi-dev=4.1.0-8 libopenmpi3=4.1.0-8 libp11-kit0=0.23.22-1 libpam-modules=1.4.0-7 libpam-modules-bin=1.4.0-7 libpam-runtime=1.4.0-7 libpam0g=1.4.0-7 libpciaccess0=0.16-1 libpcre2-8-0=10.36-2 libpcre3=2:8.39-13 libpcsclite1=1.9.1-1 libperl5.32=5.32.1-3 libpipeline1=1.5.3-1 libpmix-dev=4.0.0-4 libpmix2=4.0.0-4 libpng16-16=1.6.37-3 libpsm-infinipath1=3.3+20.604758e7-6.1 libpsm2-2=11.2.185-1 libpython3-stdlib=3.9.2-2 libpython3.9-minimal=3.9.2-1 libpython3.9-stdlib=3.9.2-1 libquadmath0=10.2.1-6 librdmacm1=33.1-1 libreadline8=8.1-1 libsaxonb-java=9.1.0.8+dfsg-2 libscalapack-mpi-dev=2.1.0-4 libscalapack-openmpi-dev=2.1.0-4 libscalapack-openmpi2.1=2.1.0-4 libseccomp2=2.5.1-1 libselinux1=3.1-3 libsemanage-common=3.1-1 libsemanage1=3.1-1+b2 libsepol1=3.1-1 libsigsegv2=2.13-1 libsmartcols1=2.36.1-7 libsqlite3-0=3.34.1-3 libssl1.1=1.1.1j-1 libstdc++-10-dev=10.2.1-6 libstdc++6=10.2.1-6 libsub-override-perl=0.09-2 libsymspg-dev=1.16.1-1 libsymspg1=1.16.1-1 libsystemd0=247.3-3 libtasn1-6=4.16.0-2 libtinfo6=6.2+20201114-2 libtirpc-common=1.3.1-1 libtirpc-dev=1.3.1-1 libtirpc3=1.3.1-1 libtool=2.4.6-15 libtsan0=10.2.1-6 libubsan1=10.2.1-6 libuchardet0=0.0.7-1 libucx0=1.10.0~rc1-7 libudev1=247.3-3 libunistring2=0.9.10-4 libuuid1=2.36.1-7 libx11-6=2:1.7.0-2 libx11-data=2:1.7.0-2 libxau6=1:1.0.9-1 libxc-dev=4.3.4-2 libxc5=4.3.4-2 libxcb1=1.14-3 libxdmcp6=1:1.1.2-3 libxerces2-java=2.12.1-1 libxext6=2:1.3.3-1.1 libxml-commons-external-java=1.4.01-5 libxml-commons-resolver1.1-java=1.2-11 libxml2=2.9.10+dfsg-6.3+b1 libxnvctrl0=460.56-1 libxom-java=1.2.10-1.1 libzstd1=1.4.8+dfsg-2.1 linux-libc-dev=5.10.24-1 login=1:4.8.1-1 lsb-base=11.1.0 m4=1.4.18-5 make=4.3-4 man-db=2.9.4-2 mawk=1.3.4.20200120-2 media-types=4.0.0 mpi-default-bin=1.13 mpi-default-dev=1.13 ncurses-base=6.2+20201114-2 ncurses-bin=6.2+20201114-2 ocl-icd-libopencl1=2.2.14-2 openjdk-11-jre-headless=11.0.11+7-1 openmpi-bin=4.1.0-8 openmpi-common=4.1.0-8 openssh-client=1:8.4p1-5 openssl=1.1.1j-1 passwd=1:4.8.1-1 patch=2.7.6-7 perl=5.32.1-3 perl-base=5.32.1-3 perl-modules-5.32=5.32.1-3 pkg-config=0.29.2-1 po-debconf=1.0.21+nmu1 python3=3.9.2-2 python3-minimal=3.9.2-2 python3.9=3.9.2-1 python3.9-minimal=3.9.2-1 readline-common=8.1-1 sed=4.7-1 sensible-utils=0.0.14 sysvinit-utils=2.96-6 tar=1.34+dfsg-1 tzdata=2021a-1 ucf=3.0043 util-linux=2.36.1-7 xz-utils=5.2.5-2 zlib1g=1:1.2.11.dfsg-2 zlib1g-dev=1:1.2.11.dfsg-2 --variant=apt --aptopt=Acquire::Check-Valid-Until "false" --aptopt=Acquire::http::Dl-Limit "1000"; --aptopt=Acquire::https::Dl-Limit "1000"; --aptopt=Acquire::Retries "5"; --aptopt=APT::Get::allow-downgrades "true"; --keyring=/usr/share/keyrings/ --essential-hook=chroot "$1" sh -c "apt-get --yes install fakeroot util-linux" --essential-hook=copy-in /usr/share/keyrings/debian-archive-bullseye-automatic.gpg /usr/share/keyrings/debian-archive-bullseye-security-automatic.gpg /usr/share/keyrings/debian-archive-bullseye-stable.gpg /usr/share/keyrings/debian-archive-buster-automatic.gpg /usr/share/keyrings/debian-archive-buster-security-automatic.gpg /usr/share/keyrings/debian-archive-buster-stable.gpg /usr/share/keyrings/debian-archive-keyring.gpg /usr/share/keyrings/debian-archive-removed-keys.gpg /usr/share/keyrings/debian-archive-stretch-automatic.gpg /usr/share/keyrings/debian-archive-stretch-security-automatic.gpg /usr/share/keyrings/debian-archive-stretch-stable.gpg /usr/share/keyrings/debian-ports-archive-keyring-removed.gpg /usr/share/keyrings/debian-ports-archive-keyring.gpg /usr/share/keyrings/debian-keyring.gpg /etc/apt/trusted.gpg.d/ --essential-hook=chroot "$1" sh -c "rm /etc/apt/sources.list && echo 'deb http://snapshot.notset.fr/archive/debian/20210814T212851Z/ bookworm main deb-src http://snapshot.notset.fr/archive/debian/20210814T212851Z/ bookworm main deb http://snapshot.notset.fr/archive/debian/20210324T023822Z/ unstable main' >> /etc/apt/sources.list && apt-get update" --customize-hook=chroot "$1" useradd --no-create-home -d /nonexistent -p "" builduser -s /bin/bash --customize-hook=chroot "$1" env sh -c "apt-get source --only-source -d cp2k=8.1-9 && mkdir -p /build/cp2k-Q381vr && dpkg-source --no-check -x /*.dsc /build/cp2k-Q381vr/cp2k-8.1 && chown -R builduser:builduser /build/cp2k-Q381vr" --customize-hook=chroot "$1" env --unset=TMPDIR runuser builduser -c "cd /build/cp2k-Q381vr/cp2k-8.1 && env DEB_BUILD_OPTIONS="parallel=4" LANG="en_US.UTF-8" LC_ADDRESS="de_DE.UTF-8" LC_ALL="C.UTF-8" LC_IDENTIFICATION="de_DE.UTF-8" LC_MEASUREMENT="de_DE.UTF-8" LC_MONETARY="de_DE.UTF-8" LC_NAME="de_DE.UTF-8" LC_NUMERIC="de_DE.UTF-8" LC_PAPER="de_DE.UTF-8" LC_TELEPHONE="de_DE.UTF-8" LC_TIME="de_DE.UTF-8" SOURCE_DATE_EPOCH="1616486572" dpkg-buildpackage -uc -a amd64 --build=all" --customize-hook=sync-out /build/cp2k-Q381vr /tmp/cp2k-8.1-9wpohlici bullseye /dev/null deb http://snapshot.notset.fr/archive/debian/20210324T023822Z unstable main I: automatically chosen mode: root I: chroot architecture amd64 is equal to the host's architecture I: automatically chosen format: tar I: using /tmp/mmdebstrap.nzJUYPQ2Hj as tempdir I: running apt-get update... I: downloading packages with apt... I: extracting archives... I: installing essential packages... I: running --essential-hook in shell: sh -c 'chroot "$1" sh -c "apt-get --yes install fakeroot util-linux"' exec /tmp/mmdebstrap.nzJUYPQ2Hj Reading package lists... Building dependency tree... util-linux is already the newest version (2.36.1-7). The following NEW packages will be installed: fakeroot libfakeroot 0 upgraded, 2 newly installed, 0 to remove and 0 not upgraded. Need to get 134 kB of archives. After this operation, 397 kB of additional disk space will be used. Get:1 http://snapshot.notset.fr/archive/debian/20210324T023822Z unstable/main amd64 libfakeroot amd64 1.25.3-1.1 [47.0 kB] Get:2 http://snapshot.notset.fr/archive/debian/20210324T023822Z unstable/main amd64 fakeroot amd64 1.25.3-1.1 [87.0 kB] debconf: delaying package configuration, since apt-utils is not installed Fetched 134 kB in 0s (864 kB/s) Selecting previously unselected package libfakeroot:amd64. (Reading database ... (Reading database ... 5% (Reading database ... 10% (Reading database ... 15% (Reading database ... 20% (Reading database ... 25% (Reading database ... 30% (Reading database ... 35% (Reading database ... 40% (Reading database ... 45% (Reading database ... 50% (Reading database ... 55% (Reading database ... 60% (Reading database ... 65% (Reading database ... 70% (Reading database ... 75% (Reading database ... 80% (Reading database ... 85% (Reading database ... 90% (Reading database ... 95% (Reading database ... 100% (Reading database ... 4663 files and directories currently installed.) Preparing to unpack .../libfakeroot_1.25.3-1.1_amd64.deb ... Unpacking libfakeroot:amd64 (1.25.3-1.1) ... Selecting previously unselected package fakeroot. Preparing to unpack .../fakeroot_1.25.3-1.1_amd64.deb ... Unpacking fakeroot (1.25.3-1.1) ... Setting up libfakeroot:amd64 (1.25.3-1.1) ... Setting up fakeroot (1.25.3-1.1) ... update-alternatives: using /usr/bin/fakeroot-sysv to provide /usr/bin/fakeroot (fakeroot) in auto mode Processing triggers for libc-bin (2.31-10) ... I: running special hook: copy-in /usr/share/keyrings/debian-archive-bullseye-automatic.gpg /usr/share/keyrings/debian-archive-bullseye-security-automatic.gpg /usr/share/keyrings/debian-archive-bullseye-stable.gpg /usr/share/keyrings/debian-archive-buster-automatic.gpg /usr/share/keyrings/debian-archive-buster-security-automatic.gpg /usr/share/keyrings/debian-archive-buster-stable.gpg /usr/share/keyrings/debian-archive-keyring.gpg /usr/share/keyrings/debian-archive-removed-keys.gpg /usr/share/keyrings/debian-archive-stretch-automatic.gpg /usr/share/keyrings/debian-archive-stretch-security-automatic.gpg /usr/share/keyrings/debian-archive-stretch-stable.gpg /usr/share/keyrings/debian-ports-archive-keyring-removed.gpg /usr/share/keyrings/debian-ports-archive-keyring.gpg /usr/share/keyrings/debian-keyring.gpg /etc/apt/trusted.gpg.d/ I: running --essential-hook in shell: sh -c 'chroot "$1" sh -c "rm /etc/apt/sources.list && echo 'deb http://snapshot.notset.fr/archive/debian/20210814T212851Z/ bookworm main deb-src http://snapshot.notset.fr/archive/debian/20210814T212851Z/ bookworm main deb http://snapshot.notset.fr/archive/debian/20210324T023822Z/ unstable main' >> /etc/apt/sources.list && apt-get update"' exec /tmp/mmdebstrap.nzJUYPQ2Hj Get:1 http://snapshot.notset.fr/archive/debian/20210814T212851Z bookworm InRelease [81.6 kB] Hit:2 http://snapshot.notset.fr/archive/debian/20210324T023822Z unstable InRelease Ign:3 http://snapshot.notset.fr/archive/debian/20210814T212851Z bookworm/main Sources Ign:4 http://snapshot.notset.fr/archive/debian/20210814T212851Z bookworm/main amd64 Packages Ign:3 http://snapshot.notset.fr/archive/debian/20210814T212851Z bookworm/main Sources Ign:4 http://snapshot.notset.fr/archive/debian/20210814T212851Z bookworm/main amd64 Packages Ign:3 http://snapshot.notset.fr/archive/debian/20210814T212851Z bookworm/main Sources Ign:4 http://snapshot.notset.fr/archive/debian/20210814T212851Z bookworm/main amd64 Packages Get:3 http://snapshot.notset.fr/archive/debian/20210814T212851Z bookworm/main Sources [11.4 MB] Get:4 http://snapshot.notset.fr/archive/debian/20210814T212851Z bookworm/main amd64 Packages [11.1 MB] Fetched 22.6 MB in 20s (1130 kB/s) Reading package lists... I: installing remaining packages inside the chroot... I: running --customize-hook in shell: sh -c 'chroot "$1" useradd --no-create-home -d /nonexistent -p "" builduser -s /bin/bash' exec /tmp/mmdebstrap.nzJUYPQ2Hj I: running --customize-hook in shell: sh -c 'chroot "$1" env sh -c "apt-get source --only-source -d cp2k=8.1-9 && mkdir -p /build/cp2k-Q381vr && dpkg-source --no-check -x /*.dsc /build/cp2k-Q381vr/cp2k-8.1 && chown -R builduser:builduser /build/cp2k-Q381vr"' exec /tmp/mmdebstrap.nzJUYPQ2Hj Reading package lists... NOTICE: 'cp2k' packaging is maintained in the 'Git' version control system at: https://salsa.debian.org/debichem-team/cp2k.git Please use: git clone https://salsa.debian.org/debichem-team/cp2k.git to retrieve the latest (possibly unreleased) updates to the package. Need to get 79.3 MB of source archives. Get:1 http://snapshot.notset.fr/archive/debian/20210814T212851Z bookworm/main cp2k 8.1-9 (dsc) [2218 B] Get:2 http://snapshot.notset.fr/archive/debian/20210814T212851Z bookworm/main cp2k 8.1-9 (tar) [79.3 MB] Get:3 http://snapshot.notset.fr/archive/debian/20210814T212851Z bookworm/main cp2k 8.1-9 (diff) [15.2 kB] Fetched 79.3 MB in 1min 4s (1239 kB/s) Download complete and in download only mode W: Download is performed unsandboxed as root as file 'cp2k_8.1-9.dsc' couldn't be accessed by user '_apt'. - pkgAcquire::Run (13: Permission denied) dpkg-source: info: extracting cp2k in /build/cp2k-Q381vr/cp2k-8.1 dpkg-source: info: unpacking cp2k_8.1.orig.tar.bz2 dpkg-source: info: unpacking cp2k_8.1-9.debian.tar.xz dpkg-source: info: using patch list from debian/patches/series dpkg-source: info: applying makeflags.patch dpkg-source: info: applying testsuite_output.patch I: running --customize-hook in shell: sh -c 'chroot "$1" env --unset=TMPDIR runuser builduser -c "cd /build/cp2k-Q381vr/cp2k-8.1 && env DEB_BUILD_OPTIONS="parallel=4" LANG="en_US.UTF-8" LC_ADDRESS="de_DE.UTF-8" LC_ALL="C.UTF-8" LC_IDENTIFICATION="de_DE.UTF-8" LC_MEASUREMENT="de_DE.UTF-8" LC_MONETARY="de_DE.UTF-8" LC_NAME="de_DE.UTF-8" LC_NUMERIC="de_DE.UTF-8" LC_PAPER="de_DE.UTF-8" LC_TELEPHONE="de_DE.UTF-8" LC_TIME="de_DE.UTF-8" SOURCE_DATE_EPOCH="1616486572" dpkg-buildpackage -uc -a amd64 --build=all"' exec /tmp/mmdebstrap.nzJUYPQ2Hj dpkg-buildpackage: info: source package cp2k dpkg-buildpackage: info: source version 8.1-9 dpkg-buildpackage: info: source distribution unstable dpkg-buildpackage: info: source changed by Michael Banck dpkg-source --before-build . debian/rules clean debian/rules:29: target 'clean' does not exist dh clean debian/rules override_dh_auto_clean make[1]: Entering directory '/build/cp2k-Q381vr/cp2k-8.1' debian/rules:32: target 'override_dh_auto_clean' does not exist cd arch && ln -fs Linux-generic-gfortran.psmp \ Linux-`uname -m`-gfortran.psmp /usr/bin/make ARCH=Linux-`uname -m`-gfortran \ VERSION=psmp distclean make[2]: Entering directory '/build/cp2k-Q381vr/cp2k-8.1' Discovering programs ... Makefile:408: target 'precommitclean' does not exist rm -rf /build/cp2k-Q381vr/cp2k-8.1/obj/precommit Makefile:339: target 'fprettyclean' does not exist rm -rf /build/cp2k-Q381vr/cp2k-8.1/obj/prettified Makefile:369: target 'doxifyclean' does not exist rm -rf /build/cp2k-Q381vr/cp2k-8.1/obj/doxified Makefile:318: target 'testclean' does not exist rm -rf /build/cp2k-Q381vr/cp2k-8.1/regtesting/Linux-x86_64-gfortran/psmp/TEST-* Makefile:322: update target 'testrealclean' due to: testclean rm -rf /build/cp2k-Q381vr/cp2k-8.1/regtesting/Linux-x86_64-gfortran/psmp/LAST-* Makefile:329: update target 'distclean' due to: precommitclean fprettyclean doxifyclean testrealclean rm -rf /build/cp2k-Q381vr/cp2k-8.1/exe /build/cp2k-Q381vr/cp2k-8.1/obj /build/cp2k-Q381vr/cp2k-8.1/lib /build/cp2k-Q381vr/cp2k-8.1/regtesting make[2]: Leaving directory '/build/cp2k-Q381vr/cp2k-8.1' cd tools/manual && rm -rf CP2K_INPUT && rm -f *.html *.xml rm -f arch/Linux-`uname -m`-gfortran.* rm -rf LAST* TEST* dh_auto_clean make -j4 distclean make[2]: Entering directory '/build/cp2k-Q381vr/cp2k-8.1' Discovering programs ... Makefile:408: target 'precommitclean' does not exist rm -rf /build/cp2k-Q381vr/cp2k-8.1/obj/precommit Makefile:339: target 'fprettyclean' does not exist rm -rf /build/cp2k-Q381vr/cp2k-8.1/obj/prettified Makefile:369: target 'doxifyclean' does not exist rm -rf /build/cp2k-Q381vr/cp2k-8.1/obj/doxified Makefile:318: target 'testclean' does not exist rm -rf /build/cp2k-Q381vr/cp2k-8.1/regtesting/local/ssmp/TEST-* Makefile:322: update target 'testrealclean' due to: testclean rm -rf /build/cp2k-Q381vr/cp2k-8.1/regtesting/local/ssmp/LAST-* Makefile:329: update target 'distclean' due to: precommitclean fprettyclean doxifyclean testrealclean rm -rf /build/cp2k-Q381vr/cp2k-8.1/exe /build/cp2k-Q381vr/cp2k-8.1/obj /build/cp2k-Q381vr/cp2k-8.1/lib /build/cp2k-Q381vr/cp2k-8.1/regtesting make[2]: Leaving directory '/build/cp2k-Q381vr/cp2k-8.1' make[1]: Leaving directory '/build/cp2k-Q381vr/cp2k-8.1' dh_clean debian/rules binary-indep debian/rules:29: target 'binary-indep' does not exist dh binary-indep dh_update_autotools_config -i dh_autoreconf -i dh_auto_configure -i debian/rules override_dh_auto_build make[1]: Entering directory '/build/cp2k-Q381vr/cp2k-8.1' debian/rules:42: target 'override_dh_auto_build' does not exist cd arch && ln -fs Linux-generic-gfortran.psmp \ Linux-`uname -m`-gfortran.psmp /usr/bin/make ARCH=Linux-`uname -m`-gfortran \ VERSION=psmp PYTHON=python3 all make[2]: Entering directory '/build/cp2k-Q381vr/cp2k-8.1' Discovering programs ... Makefile:121: target 'all' does not exist /usr/bin/make --no-print-directory -f /build/cp2k-Q381vr/cp2k-8.1/Makefile psmp ORIG_TARGET=all /build/cp2k-Q381vr/cp2k-8.1/Makefile:126: target 'psmp' does not exist /usr/bin/make --no-print-directory -f /build/cp2k-Q381vr/cp2k-8.1/Makefile all ORIG_TARGET="" VERSION="" ONEVERSION=psmp /build/cp2k-Q381vr/cp2k-8.1/Makefile:169: target 'dirs' does not exist mkdir -p /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp mkdir -p /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts mkdir -p /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp mkdir -p /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts mkdir -p /build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran mkdir -p /build/cp2k-Q381vr/cp2k-8.1/regtesting/Linux-x86_64-gfortran/psmp /build/cp2k-Q381vr/cp2k-8.1/Makefile:448: update target 'makedep' due to: /build/cp2k-Q381vr/cp2k-8.1/src/lri_ks_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/kg_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/grrm_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_eip.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_diis_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_initialization.F /build/cp2k-Q381vr/cp2k-8.1/src/ewald_methods_tb.F /build/cp2k-Q381vr/cp2k-8.1/src/hfx_pair_list_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_distribution_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_post_scf.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_core_energies.F /build/cp2k-Q381vr/cp2k-8.1/src/manybody_tersoff.F /build/cp2k-Q381vr/cp2k-8.1/src/mao_basis.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gaussian_data.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_ot_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_sccs.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_update_s_mstruct.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_atomic_halo_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho0_types.F /build/cp2k-Q381vr/cp2k-8.1/src/preconditioner_apply.F /build/cp2k-Q381vr/cp2k-8.1/src/fist_efield_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_efield_local.F /build/cp2k-Q381vr/cp2k-8.1/src/iterate_matrix.F /build/cp2k-Q381vr/cp2k-8.1/src/core_ppnl.F /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_create.F /build/cp2k-Q381vr/cp2k-8.1/src/constraint_vsite.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho_atom_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/pw_env/pw_env_types.F /build/cp2k-Q381vr/cp2k-8.1/src/pw_env/cp_spline_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/pw_env/rs_pw_interface.F /build/cp2k-Q381vr/cp2k-8.1/src/pw_env/gaussian_gridlevels.F /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_io.F /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_data_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_api.F /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_geev.F /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy_init.F /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_env_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/pao_potentials.F /build/cp2k-Q381vr/cp2k-8.1/src/submatrix_types.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_free_energy.F /build/cp2k-Q381vr/cp2k-8.1/src/cp_external_control.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_apply_restraints.F /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_correction.F /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/pexsi_interface.F /build/cp2k-Q381vr/cp2k-8.1/src/pair_potential_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_qmmm_types.F /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_mpole_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_grid_atom.F /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm_master.F /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm_input.F /build/cp2k-Q381vr/cp2k-8.1/src/swarm/glbopt_history.F /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm_message.F /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm_mpi.F /build/cp2k-Q381vr/cp2k-8.1/src/swarm/glbopt_mincrawl.F /build/cp2k-Q381vr/cp2k-8.1/src/swarm/glbopt_minhop.F /build/cp2k-Q381vr/cp2k-8.1/src/swarm/glbopt_input.F /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm.F /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm_worker.F /build/cp2k-Q381vr/cp2k-8.1/src/swarm/glbopt_worker.F /build/cp2k-Q381vr/cp2k-8.1/src/swarm/glbopt_master.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_efield_berry.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_issc_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_integrate.F /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_types.F /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_error_control.F /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_test.F /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_gaussian.F /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_util.F /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_lattice_summation.F /build/cp2k-Q381vr/cp2k-8.1/src/mp2.F /build/cp2k-Q381vr/cp2k-8.1/src/taper_types.F /build/cp2k-Q381vr/cp2k-8.1/src/cp2k_debug.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_kpp1_env_types.F /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml_gaussprocess.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_ec.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_ot.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_electric_field_gradient.F /build/cp2k-Q381vr/cp2k-8.1/src/negf_green_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt_eigensolver.F /build/cp2k-Q381vr/cp2k-8.1/src/stm_images.F /build/cp2k-Q381vr/cp2k-8.1/src/preconditioner.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gpw_forces.F /build/cp2k-Q381vr/cp2k-8.1/src/lri_optimize_ri_basis.F /build/cp2k-Q381vr/cp2k-8.1/src/ec_efield_local.F /build/cp2k-Q381vr/cp2k-8.1/src/force_env_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_densities.F /build/cp2k-Q381vr/cp2k-8.1/src/farming_types.F /build/cp2k-Q381vr/cp2k-8.1/src/maxwell_solver_interface.F /build/cp2k-Q381vr/cp2k-8.1/src/xtb_parameters.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_environment_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/se_fock_matrix_dbg.F /build/cp2k-Q381vr/cp2k-8.1/src/topology.F /build/cp2k-Q381vr/cp2k-8.1/src/topology_gromos.F /build/cp2k-Q381vr/cp2k-8.1/src/manybody_eam.F /build/cp2k-Q381vr/cp2k-8.1/src/cp_realspace_grid_init.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_module.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_gcp_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_arrays.F /build/cp2k-Q381vr/cp2k-8.1/src/xtb_types.F /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_propagation_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_propagator_init.F /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_delta_pulse.F /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_hfx_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_make_propagators.F /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_propagation_output.F /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_propagation_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/negf_alloc_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_o3c_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/rmsd.F /build/cp2k-Q381vr/cp2k-8.1/src/hartree_local_types.F /build/cp2k-Q381vr/cp2k-8.1/src/preconditioner_types.F /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_ana.F /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_atom.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_mm.F /build/cp2k-Q381vr/cp2k-8.1/src/fp_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_ot_eigensolver.F /build/cp2k-Q381vr/cp2k-8.1/src/auto_basis.F /build/cp2k-Q381vr/cp2k-8.1/src/optimize_basis_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/ec_environment.F /build/cp2k-Q381vr/cp2k-8.1/src/constraint_4x6.F /build/cp2k-Q381vr/cp2k-8.1/src/hirshfeld_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml_descriptor.F /build/cp2k-Q381vr/cp2k-8.1/src/rt_propagation_types.F /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_num.F /build/cp2k-Q381vr/cp2k-8.1/src/subcell_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho0_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_curvy.F /build/cp2k-Q381vr/cp2k-8.1/src/lri_compression.F /build/cp2k-Q381vr/cp2k-8.1/src/minimax/minimax_exp_k15.F /build/cp2k-Q381vr/cp2k-8.1/src/minimax/minimax_rpa.F /build/cp2k-Q381vr/cp2k-8.1/src/minimax/minimax_exp.F /build/cp2k-Q381vr/cp2k-8.1/src/minimax/minimax_exp_gw.F /build/cp2k-Q381vr/cp2k-8.1/src/minimax/minimax_exp_k53.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_operators_r12.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_coulomb_test.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap_aabb.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/basis_set_container_types.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_elec_field.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_os_rr.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_verfc.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap3_debug.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/sto_ng.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ao_util.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_derivatives.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap3.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_contraction_sphi.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/orbital_symbols.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_moments.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_coulomb.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_eri_debug.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/soft_basis_set.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_angmom.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_kinetic.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap_debug.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_oneelectron.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/orbital_pointers.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap_ppl.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/basis_set_types.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/orbital_transformation_matrices.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/aux_basis_set.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_fermi_contact.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_spin_orbit.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_onecenter.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_contraction.F /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_operator_ra2m.F /build/cp2k-Q381vr/cp2k-8.1/src/fist_neighbor_lists.F /build/cp2k-Q381vr/cp2k-8.1/src/bse.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_block_davidson.F /build/cp2k-Q381vr/cp2k-8.1/src/molden_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/hfxbase/hfx_contraction_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/hfxbase/hfx_compression_core_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/hfxbase/hfx_contract_block.F /build/cp2k-Q381vr/cp2k-8.1/src/atom_xc.F /build/cp2k-Q381vr/cp2k-8.1/src/replica_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/optbas_opt_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/lri_integrals.F /build/cp2k-Q381vr/cp2k-8.1/src/motion_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/nnp_model.F /build/cp2k-Q381vr/cp2k-8.1/src/libint_wrapper.F /build/cp2k-Q381vr/cp2k-8.1/src/input_optimize_input.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_types.F /build/cp2k-Q381vr/cp2k-8.1/src/cp_control_types.F /build/cp2k-Q381vr/cp2k-8.1/src/mp2_optimize_ri_basis.F /build/cp2k-Q381vr/cp2k-8.1/src/ewald_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/src/se_fock_matrix_exchange.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_kinetic.F /build/cp2k-Q381vr/cp2k-8.1/src/pw_env_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_loop_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/ewald_pw_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/fist_neighbor_list_control.F /build/cp2k-Q381vr/cp2k-8.1/src/atom_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_global.F /build/cp2k-Q381vr/cp2k-8.1/src/dft_plus_u.F /build/cp2k-Q381vr/cp2k-8.1/src/molsym.F /build/cp2k-Q381vr/cp2k-8.1/src/response_solver.F /build/cp2k-Q381vr/cp2k-8.1/src/mao_types.F /build/cp2k-Q381vr/cp2k-8.1/src/external_potential_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/rpa_kpoints.F /build/cp2k-Q381vr/cp2k-8.1/src/virial_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_hash_table_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F /build/cp2k-Q381vr/cp2k-8.1/src/xas_tp_scf.F /build/cp2k-Q381vr/cp2k-8.1/src/atom_optimization.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_colvar.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmmx_types.F /build/cp2k-Q381vr/cp2k-8.1/src/cp_ddapc_types.F /build/cp2k-Q381vr/cp2k-8.1/src/cell_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_nl_hash_table_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_io.F /build/cp2k-Q381vr/cp2k-8.1/src/matrix_exp.F /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_lbfgs_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_subsys_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/ewald_pw_types.F /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_debug.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_integrate_potential.F /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_parameters.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_atprop.F /build/cp2k-Q381vr/cp2k-8.1/src/negf_env_types.F /build/cp2k-Q381vr/cp2k-8.1/src/pair_potential.F /build/cp2k-Q381vr/cp2k-8.1/src/transport_env_types.F /build/cp2k-Q381vr/cp2k-8.1/src/library_tests.F /build/cp2k-Q381vr/cp2k-8.1/src/optbas_fenv_manipulation.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_per_elpot.F /build/cp2k-Q381vr/cp2k-8.1/src/start/libcp2k.F /build/cp2k-Q381vr/cp2k-8.1/src/start/input_cp2k_motion.F /build/cp2k-Q381vr/cp2k-8.1/src/start/cp2k.F /build/cp2k-Q381vr/cp2k-8.1/src/start/cp2k_runs.F /build/cp2k-Q381vr/cp2k-8.1/src/start/cp2k_shell.F /build/cp2k-Q381vr/cp2k-8.1/src/start/input_cp2k.F /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F /build/cp2k-Q381vr/cp2k-8.1/src/cp_eri_mme_interface.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_env_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_cholesky.F /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_pool_types.F /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_struct.F /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_diag_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_vect.F /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_blacs_calls.F /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_diag.F /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_cfm_types.F /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_elpa.F /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_linked_list_fm.F /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_cfm_basic_linalg.F /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_cfm_diag.F /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_blacs_env.F /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_basic_linalg.F /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_types.F /build/cp2k-Q381vr/cp2k-8.1/src/xas_restart.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_types.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_dft.F /build/cp2k-Q381vr/cp2k-8.1/src/replica_types.F /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_grad.F /build/cp2k-Q381vr/cp2k-8.1/src/cryssym.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_nmr_epr_common_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_diis_types.F /build/cp2k-Q381vr/cp2k-8.1/src/pwdft_environment.F /build/cp2k-Q381vr/cp2k-8.1/src/pao_param.F /build/cp2k-Q381vr/cp2k-8.1/src/splines_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/metadynamics_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_o3c_types.F /build/cp2k-Q381vr/cp2k-8.1/src/simpar_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_diis.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_gspace_mixing.F /build/cp2k-Q381vr/cp2k-8.1/src/admm_types.F /build/cp2k-Q381vr/cp2k-8.1/src/block_p_types.F /build/cp2k-Q381vr/cp2k-8.1/src/topology_generate_util.F /build/cp2k-Q381vr/cp2k-8.1/src/spglib_f08.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gpw_energy.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gaussian_types.F /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.F /build/cp2k-Q381vr/cp2k-8.1/src/mao_optimizer.F /build/cp2k-Q381vr/cp2k-8.1/src/negf_control_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_force_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gaussian_input.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_types_low.F /build/cp2k-Q381vr/cp2k-8.1/src/mm_collocate_potential.F /build/cp2k-Q381vr/cp2k-8.1/src/optimize_basis.F /build/cp2k-Q381vr/cp2k-8.1/src/molecular_states.F /build/cp2k-Q381vr/cp2k-8.1/src/negf_integr_cc.F /build/cp2k-Q381vr/cp2k-8.1/src/fist_force.F /build/cp2k-Q381vr/cp2k-8.1/src/force_fields_ext.F /build/cp2k-Q381vr/cp2k-8.1/src/atom.F /build/cp2k-Q381vr/cp2k-8.1/src/minbas_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_qs.F /build/cp2k-Q381vr/cp2k-8.1/src/manybody_gal.F /build/cp2k-Q381vr/cp2k-8.1/src/pao_input.F /build/cp2k-Q381vr/cp2k-8.1/src/input_constants.F /build/cp2k-Q381vr/cp2k-8.1/src/mm_mapping_library.F /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml_neuralnet.F /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_gpw.F /build/cp2k-Q381vr/cp2k-8.1/src/atom_upf.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_gapw_densities.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_ot_scf.F /build/cp2k-Q381vr/cp2k-8.1/src/et_coupling.F /build/cp2k-Q381vr/cp2k-8.1/src/force_fields_input.F /build/cp2k-Q381vr/cp2k-8.1/src/se_fock_matrix_coulomb.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_negf.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_com_tasks_types.F /build/cp2k-Q381vr/cp2k-8.1/src/kg_correction.F /build/cp2k-Q381vr/cp2k-8.1/src/pme.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_pwdft.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_integrate_potential_product.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_overlap.F /build/cp2k-Q381vr/cp2k-8.1/src/hfx_communication.F /build/cp2k-Q381vr/cp2k-8.1/src/se_core_core.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_coulomb.F /build/cp2k-Q381vr/cp2k-8.1/src/topology_connectivity_util.F /build/cp2k-Q381vr/cp2k-8.1/src/bsse.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_density_mixing_types.F /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_coulomb_2c.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_image_charge.F /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_chebyshev.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_current_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_localization_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/optimize_embedding_potential.F /build/cp2k-Q381vr/cp2k-8.1/src/beta_gamma_psi.F /build/cp2k-Q381vr/cp2k-8.1/src/topology_coordinate_util.F /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int3_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_operators.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_subsys.F /build/cp2k-Q381vr/cp2k-8.1/src/input_restart_force_eval.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_p_env_types.F /build/cp2k-Q381vr/cp2k-8.1/src/rpa_rse.F /build/cp2k-Q381vr/cp2k-8.1/src/lri_optimize_ri_basis_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_condnum.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_nmr_shift.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_tb.F /build/cp2k-Q381vr/cp2k-8.1/src/force_env_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/atom_admm_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/input_restart_rng.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_hfx.F /build/cp2k-Q381vr/cp2k-8.1/src/kg_environment.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_eigensolver.F /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_expns3_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/pao_io.F /build/cp2k-Q381vr/cp2k-8.1/src/lri_environment_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/extended_system_types.F /build/cp2k-Q381vr/cp2k-8.1/src/environment.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_types.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbr_pbe_lda_hole_t_c_lr.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_derivative_types.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_tpss.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_rho_cflags_types.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_optx.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xalpha.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_b97.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_cs1.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_derivatives.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_libxc_wrap.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_sr_lda.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_atom.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew86.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_rho_set_types.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_exchange_gga.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_pade.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_libxc.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_pbe.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_thomas_fermi.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbeef.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_hcth.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_functionals_utilities.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/cp_linked_list_xc_deriv.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_ke_gga.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_derivative_set_types.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_tfw.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_derivative_desc.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_zunger.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_input_constants.F /build/cp2k-Q381vr/cp2k-8.1/src/task_list_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_input.F /build/cp2k-Q381vr/cp2k-8.1/src/negf_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/submatrix_dissection.F /build/cp2k-Q381vr/cp2k-8.1/src/lri_environment_init.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_dos.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_period_efield_types.F /build/cp2k-Q381vr/cp2k-8.1/src/shg_integrals_test.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/distribution_2d_types.F /build/cp2k-Q381vr/cp2k-8.1/src/wannier_states_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_collocate_density.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_trial_fns_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/pwdft_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_vxc.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_outer_scf.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_post_se.F /build/cp2k-Q381vr/cp2k-8.1/src/eip_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/src/atom_electronic_structure.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_wf_history_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/mode_selective.F /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_grad_util.F /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_2c.F /build/cp2k-Q381vr/cp2k-8.1/src/topology_xtl.F /build/cp2k-Q381vr/cp2k-8.1/src/mixed_energy_types.F /build/cp2k-Q381vr/cp2k-8.1/src/ewalds_multipole.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_states.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_integral_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy_window.F /build/cp2k-Q381vr/cp2k-8.1/src/mp2_gpw.F /build/cp2k-Q381vr/cp2k-8.1/src/efield_tb_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_mom_types.F /build/cp2k-Q381vr/cp2k-8.1/src/negf_vectors.F /build/cp2k-Q381vr/cp2k-8.1/src/constraint_fxd.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_epr_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb3_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/pair_potential_coulomb.F /build/cp2k-Q381vr/cp2k-8.1/src/rel_control_types.F /build/cp2k-Q381vr/cp2k-8.1/src/surface_dipole.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/topology_pdb.F /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_api.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_constraints.F /build/cp2k-Q381vr/cp2k-8.1/src/pao_types.F /build/cp2k-Q381vr/cp2k-8.1/src/fist_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F /build/cp2k-Q381vr/cp2k-8.1/src/rpa_im_time.F /build/cp2k-Q381vr/cp2k-8.1/src/constraint_clv.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_core_hamiltonian.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_kpoints.F /build/cp2k-Q381vr/cp2k-8.1/src/hfx_compression_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_external_potential.F /build/cp2k-Q381vr/cp2k-8.1/src/domain_submatrix_types.F /build/cp2k-Q381vr/cp2k-8.1/src/topology_psf.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_field.F /build/cp2k-Q381vr/cp2k-8.1/src/atom_sgp.F /build/cp2k-Q381vr/cp2k-8.1/src/pair_potential_util.F /build/cp2k-Q381vr/cp2k-8.1/src/mp2_integrals.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_dipole.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_resp.F /build/cp2k-Q381vr/cp2k-8.1/src/mulliken.F /build/cp2k-Q381vr/cp2k-8.1/src/constraint_util.F /build/cp2k-Q381vr/cp2k-8.1/src/voronoi_interface.F /build/cp2k-Q381vr/cp2k-8.1/src/cp_dbcsr_cp2k_link.F /build/cp2k-Q381vr/cp2k-8.1/src/exclusion_types.F /build/cp2k-Q381vr/cp2k-8.1/src/shg_int/generic_shg_integrals_init.F /build/cp2k-Q381vr/cp2k-8.1/src/shg_int/s_contract_shg.F /build/cp2k-Q381vr/cp2k-8.1/src/shg_int/constants_operator.F /build/cp2k-Q381vr/cp2k-8.1/src/shg_int/generic_shg_integrals.F /build/cp2k-Q381vr/cp2k-8.1/src/shg_int/construct_shg.F /build/cp2k-Q381vr/cp2k-8.1/src/negf_atom_map.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_force_eval.F /build/cp2k-Q381vr/cp2k-8.1/src/force_fields_all.F /build/cp2k-Q381vr/cp2k-8.1/src/negf_integr_simpson.F /build/cp2k-Q381vr/cp2k-8.1/src/cp_gemm_interface.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_xc.F /build/cp2k-Q381vr/cp2k-8.1/src/fermi_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/dielectric_types.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/dct.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/dgs.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_kernel.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft_tools.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/dg_rho0_types.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/rs_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/cube_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/dg_types.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/mt_util.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/lazy.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_types.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/realspace_grid_cube.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_types.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_grid_info.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_spline_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/dielectric_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_fft3d.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_grids.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/realspace_grid_types.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_grid_types.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_scaling_function.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_pool_types.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_implicit_types.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_fpga.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_base.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_implicit_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/cp_linked_list_pw.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/dirichlet_bc_types.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_poisson_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_cuda.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/fast.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_poisson_types.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_util.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/fft_kinds.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/fftsg_lib.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/fft_plan.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/fft_lib.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/fftw3_lib.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/mltfftsg_tools.F /build/cp2k-Q381vr/cp2k-8.1/src/pw/dirichlet_bc_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/pao_linpot_full.F /build/cp2k-Q381vr/cp2k-8.1/src/constraint.F /build/cp2k-Q381vr/cp2k-8.1/src/constraint_3x3.F /build/cp2k-Q381vr/cp2k-8.1/src/fist_main.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_properties_dft.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_properties.F /build/cp2k-Q381vr/cp2k-8.1/src/rpa_communication.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmmx_update.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_scf_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmmx_util.F /build/cp2k-Q381vr/cp2k-8.1/src/optimize_input.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_gcp_method.F /build/cp2k-Q381vr/cp2k-8.1/src/ewalds.F /build/cp2k-Q381vr/cp2k-8.1/src/fist_pol_scf.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_commutators.F /build/cp2k-Q381vr/cp2k-8.1/src/core_ppl.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_wfn_mix.F /build/cp2k-Q381vr/cp2k-8.1/src/hfx_admm_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/topology_cif.F /build/cp2k-Q381vr/cp2k-8.1/src/mp2_gpw_method.F /build/cp2k-Q381vr/cp2k-8.1/src/cp_ddapc_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/integration_grid_types.F /build/cp2k-Q381vr/cp2k-8.1/src/mao_wfn_analysis.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_gamma2kp.F /build/cp2k-Q381vr/cp2k-8.1/src/atom_basis.F /build/cp2k-Q381vr/cp2k-8.1/src/negf_matrix_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/src/dkh_main.F /build/cp2k-Q381vr/cp2k-8.1/src/scf_control_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_moments.F /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_libint.F /build/cp2k-Q381vr/cp2k-8.1/src/domain_submatrix_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/ct_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/embed_environment.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_mixing_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/colvar_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/xas_env_types.F /build/cp2k-Q381vr/cp2k-8.1/src/outer_scf_control_types.F /build/cp2k-Q381vr/cp2k-8.1/src/nnp_acsf.F /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph.F /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_kernel.F /build/cp2k-Q381vr/cp2k-8.1/src/eip_environment.F /build/cp2k-Q381vr/cp2k-8.1/src/embed_main.F /build/cp2k-Q381vr/cp2k-8.1/src/negf_integr_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_mixed.F /build/cp2k-Q381vr/cp2k-8.1/src/molecular_dipoles.F /build/cp2k-Q381vr/cp2k-8.1/src/basis_set_output.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho_types.F /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_transitional.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_env_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_post_tb.F /build/cp2k-Q381vr/cp2k-8.1/src/cp_realspace_grid_cube.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_gcp_types.F /build/cp2k-Q381vr/cp2k-8.1/src/admm_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/lri_forces.F /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_kpoints.F /build/cp2k-Q381vr/cp2k-8.1/src/gle_system_types.F /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_mpole_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/cp_symmetry.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_atomic_matrix_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/pao_param_linpot.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_transport.F /build/cp2k-Q381vr/cp2k-8.1/src/kg_tnadd_mat.F /build/cp2k-Q381vr/cp2k-8.1/src/se_fock_matrix_integrals.F /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_types.F /build/cp2k-Q381vr/cp2k-8.1/src/manybody_potential.F /build/cp2k-Q381vr/cp2k-8.1/src/fist_energy_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_init.F /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_integrals.F /build/cp2k-Q381vr/cp2k-8.1/src/cp_dbcsr_diag.F /build/cp2k-Q381vr/cp2k-8.1/src/task_list_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_epr_nablavks.F /build/cp2k-Q381vr/cp2k-8.1/src/cp_control_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/mdctrl_types.F /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/ri_environment_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_elf_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/rpa_util.F /build/cp2k-Q381vr/cp2k-8.1/src/force_env_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_nmr_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_integrals.F /build/cp2k-Q381vr/cp2k-8.1/src/hfx_helpers.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_ls.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_mom_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_environment.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_vxc_atom.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_ot_minimizer.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_band_structure.F /build/cp2k-Q381vr/cp2k-8.1/src/mp2_grids.F /build/cp2k-Q381vr/cp2k-8.1/src/rt_propagation_forces.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F /build/cp2k-Q381vr/cp2k-8.1/src/atom_kind_orbitals.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_tb_coulomb.F /build/cp2k-Q381vr/cp2k-8.1/src/base/machine.F /build/cp2k-Q381vr/cp2k-8.1/src/base/kinds.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_hooks.F /build/cp2k-Q381vr/cp2k-8.1/src/base/machine_internal.F /build/cp2k-Q381vr/cp2k-8.1/src/sirius_interface.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_molecules.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_epr_ownutils.F /build/cp2k-Q381vr/cp2k-8.1/src/eip_silicon.F /build/cp2k-Q381vr/cp2k-8.1/src/optimize_dmfet_potential.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_force.F /build/cp2k-Q381vr/cp2k-8.1/src/cp_ddapc_forces.F /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_par_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/energy_corrections.F /build/cp2k-Q381vr/cp2k-8.1/src/topology_util.F /build/cp2k-Q381vr/cp2k-8.1/src/preconditioner_makes.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_charge_mixing.F /build/cp2k-Q381vr/cp2k-8.1/src/admm_dm_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho_atom_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_force.F /build/cp2k-Q381vr/cp2k-8.1/src/cp_ddapc.F /build/cp2k-Q381vr/cp2k-8.1/src/negf_subgroup_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_polar_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/libint_2c_3c.F /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_store_int_types.F /build/cp2k-Q381vr/cp2k-8.1/src/xas_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/hfx_types.F /build/cp2k-Q381vr/cp2k-8.1/src/pao_param_fock.F /build/cp2k-Q381vr/cp2k-8.1/src/xas_control.F /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_se_energy.F /build/cp2k-Q381vr/cp2k-8.1/src/population_analyses.F /build/cp2k-Q381vr/cp2k-8.1/src/mixed_main.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_elpot.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_oce_types.F /build/cp2k-Q381vr/cp2k-8.1/src/manybody_siepmann.F /build/cp2k-Q381vr/cp2k-8.1/src/topology_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_types.F /build/cp2k-Q381vr/cp2k-8.1/src/f77_interface.F /build/cp2k-Q381vr/cp2k-8.1/src/hfx_ri.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_block_davidson_types.F /build/cp2k-Q381vr/cp2k-8.1/src/mscfg_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/mp2_cphf.F /build/cp2k-Q381vr/cp2k-8.1/src/colvar_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/pilaenv_hack.F /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_neighbor_list_types.F /build/cp2k-Q381vr/cp2k-8.1/src/hirshfeld_types.F /build/cp2k-Q381vr/cp2k-8.1/src/pao_optimizer.F /build/cp2k-Q381vr/cp2k-8.1/src/fp_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_current.F /build/cp2k-Q381vr/cp2k-8.1/src/ec_env_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gaussian_init.F /build/cp2k-Q381vr/cp2k-8.1/src/force_fields.F /build/cp2k-Q381vr/cp2k-8.1/src/topology_cp2k.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_tb_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/efield_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_restarts_util.F /build/cp2k-Q381vr/cp2k-8.1/src/spme.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_wf_history_types.F /build/cp2k-Q381vr/cp2k-8.1/src/global_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_kpp1_env_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_output.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_lanczos.F /build/cp2k-Q381vr/cp2k-8.1/src/farming_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/topology_amber.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_atom_current.F /build/cp2k-Q381vr/cp2k-8.1/src/mp2_setup.F /build/cp2k-Q381vr/cp2k-8.1/src/pao_param_gth.F /build/cp2k-Q381vr/cp2k-8.1/src/scine_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_epr_hyp.F /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_gks.F /build/cp2k-Q381vr/cp2k-8.1/src/optimize_basis_types.F /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_neighbor_lists.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_stda_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/nnp_environment.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_opt_types.F /build/cp2k-Q381vr/cp2k-8.1/src/mol_force.F /build/cp2k-Q381vr/cp2k-8.1/src/wannier90.F /build/cp2k-Q381vr/cp2k-8.1/src/fist_efield_types.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_nnp.F /build/cp2k-Q381vr/cp2k-8.1/src/cp_dbcsr_cholesky.F /build/cp2k-Q381vr/cp2k-8.1/src/al_system_types.F /build/cp2k-Q381vr/cp2k-8.1/src/xtb_matrices.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_matrix_pools.F /build/cp2k-Q381vr/cp2k-8.1/src/fist_neighbor_list_types.F /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/atom_operators.F /build/cp2k-Q381vr/cp2k-8.1/src/core_ae.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_oce_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/mixed_environment.F /build/cp2k-Q381vr/cp2k-8.1/src/ls_matrix_exp.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_qmmm_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/atomic_charges.F /build/cp2k-Q381vr/cp2k-8.1/src/cp2k_info.F /build/cp2k-Q381vr/cp2k-8.1/src/xtb_coulomb.F /build/cp2k-Q381vr/cp2k-8.1/src/ipi_driver.F /build/cp2k-Q381vr/cp2k-8.1/src/xc_adiabatic_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/debug_os_integrals.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_occupation.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_tensors_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_elec_field.F /build/cp2k-Q381vr/cp2k-8.1/src/moments_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/hfx_load_balance_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_types.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/dimer_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/reftraj_util.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_run.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_public.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_param_types.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/dimer_types.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_f_types.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/mdctrl_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_io.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/vibrational_analysis.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/cell_opt_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/barostat_types.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/al_system_init.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/csvr_system_dynamics.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_mapping.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/extended_system_init.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/gle_system_dynamics.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/extended_system_mapping.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_types.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/csvr_system_init.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/input_cp2k_barostats.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/extended_system_dynamics.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/al_system_dynamics.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/csvr_system_mapping.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/al_system_mapping.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/barostat_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/bfgs_optimizer.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_normalmode.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/cg_optimizer.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/shell_opt.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_io.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/simpar_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_ener_types.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/dumpdcd.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_opt_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/cg_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/input_cp2k_md.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/integrator_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/free_energy_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/dimer_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_conserved_quantities.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/glbopt_callback.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/geo_opt.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_types.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_worm.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_common.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/cell_opt.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/velocity_verlet_control.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/wiener_process.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_types.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_energies.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_f_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_f77_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_transformations.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/averages_types.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/cell_opt_types.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/xyz2dcd.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_sampling.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_io.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/cp_lbfgs_geo.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_util.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/cp_lbfgs_optimizer_gopt.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/cp_lbfgs.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/reftraj_types.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/rt_propagation.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_piglet.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermal_region_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_pile.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_staging.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_md_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_vel_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_gle.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermal_region_types.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/input_cp2k_vib.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_run.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/tamc_run.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_coordinates.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_types.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_ensembles.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_moves.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_move_control.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_control.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_ge_moves.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_misc.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/input_cp2k_restarts.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_qtb.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/integrator.F /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_interactions.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_poisson.F /build/cp2k-Q381vr/cp2k-8.1/src/restraint.F /build/cp2k-Q381vr/cp2k-8.1/src/transport.F /build/cp2k-Q381vr/cp2k-8.1/src/cp_ddapc_util.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_operators_ao.F /build/cp2k-Q381vr/cp2k-8.1/src/subsys/shell_potential_types.F /build/cp2k-Q381vr/cp2k-8.1/src/subsys/damping_dipole_types.F /build/cp2k-Q381vr/cp2k-8.1/src/subsys/atprop_types.F /build/cp2k-Q381vr/cp2k-8.1/src/subsys/external_potential_types.F /build/cp2k-Q381vr/cp2k-8.1/src/subsys/atomic_kind_types.F /build/cp2k-Q381vr/cp2k-8.1/src/subsys/molecule_list_types.F /build/cp2k-Q381vr/cp2k-8.1/src/subsys/colvar_types.F /build/cp2k-Q381vr/cp2k-8.1/src/subsys/molecule_types.F /build/cp2k-Q381vr/cp2k-8.1/src/subsys/atomic_kind_list_types.F /build/cp2k-Q381vr/cp2k-8.1/src/subsys/multipole_types.F /build/cp2k-Q381vr/cp2k-8.1/src/subsys/cp_subsys_types.F /build/cp2k-Q381vr/cp2k-8.1/src/subsys/particle_types.F /build/cp2k-Q381vr/cp2k-8.1/src/subsys/particle_list_types.F /build/cp2k-Q381vr/cp2k-8.1/src/subsys/molecule_kind_list_types.F /build/cp2k-Q381vr/cp2k-8.1/src/subsys/force_field_kind_types.F /build/cp2k-Q381vr/cp2k-8.1/src/subsys/molecule_kind_types.F /build/cp2k-Q381vr/cp2k-8.1/src/subsys/cell_types.F /build/cp2k-Q381vr/cp2k-8.1/src/subsys/virial_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_fhxc.F /build/cp2k-Q381vr/cp2k-8.1/src/s_square_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_stda_types.F /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_matrix_data_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_topology_util.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_hash_table_functions.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt_types.F /build/cp2k-Q381vr/cp2k-8.1/src/rtp_admm_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_qs.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_initial_guess.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_kind_types.F /build/cp2k-Q381vr/cp2k-8.1/src/distribution_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/csvr_system_types.F /build/cp2k-Q381vr/cp2k-8.1/src/rpa_main.F /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho0_ggrid.F /build/cp2k-Q381vr/cp2k-8.1/src/linesearch.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_read.F /build/cp2k-Q381vr/cp2k-8.1/src/metadynamics_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/mao_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/atoms_input.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmmx_force.F /build/cp2k-Q381vr/cp2k-8.1/src/atom_output.F /build/cp2k-Q381vr/cp2k-8.1/src/negf_green_cache.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_wannier90.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_links_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_local_properties.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_distribution.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_motion_print.F /build/cp2k-Q381vr/cp2k-8.1/src/paw_proj_set_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_se_forces.F /build/cp2k-Q381vr/cp2k-8.1/src/admm_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_spin_orbit.F /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_im_time_util.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_tensors.F /build/cp2k-Q381vr/cp2k-8.1/src/hfx_libint_interface.F /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_optimizer.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_op.F /build/cp2k-Q381vr/cp2k-8.1/src/cp_subsys_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_post_gpw.F /build/cp2k-Q381vr/cp2k-8.1/src/xray_diffraction.F /build/cp2k-Q381vr/cp2k-8.1/src/ewald_spline_util.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_subgroups.F /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/header.F /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F /build/cp2k-Q381vr/cp2k-8.1/src/cp_dbcsr_operations.F /build/cp2k-Q381vr/cp2k-8.1/src/mixed_environment_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_types.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_almo.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_rsgrid.F /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_expns3_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy_matrix_w.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_create.F /build/cp2k-Q381vr/cp2k-8.1/src/csvr_system_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_harmonics_atom.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_pw_grid.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_charges_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt_module.F /build/cp2k-Q381vr/cp2k-8.1/src/manybody_quip.F /build/cp2k-Q381vr/cp2k-8.1/src/minbas_wfn_analysis.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/rpa_axk.F /build/cp2k-Q381vr/cp2k-8.1/src/et_coupling_proj.F /build/cp2k-Q381vr/cp2k-8.1/src/pao_param_exp.F /build/cp2k-Q381vr/cp2k-8.1/src/graphcon.F /build/cp2k-Q381vr/cp2k-8.1/src/molecular_moments.F /build/cp2k-Q381vr/cp2k-8.1/src/mp2_laplace.F /build/cp2k-Q381vr/cp2k-8.1/src/nnp_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/src/atom_types.F /build/cp2k-Q381vr/cp2k-8.1/src/kg_vertex_coloring_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/common/timings_report.F /build/cp2k-Q381vr/cp2k-8.1/src/common/distribution_1d_types.F /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_para_env.F /build/cp2k-Q381vr/cp2k-8.1/src/common/bessel_lib.F /build/cp2k-Q381vr/cp2k-8.1/src/common/lapack.F /build/cp2k-Q381vr/cp2k-8.1/src/common/cg_test.F /build/cp2k-Q381vr/cp2k-8.1/src/common/mathlib.F /build/cp2k-Q381vr/cp2k-8.1/src/common/routine_map.F /build/cp2k-Q381vr/cp2k-8.1/src/common/kahan_sum.F /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_array_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/common/reference_manager.F /build/cp2k-Q381vr/cp2k-8.1/src/common/list_routinereport.F /build/cp2k-Q381vr/cp2k-8.1/src/common/string_table.F /build/cp2k-Q381vr/cp2k-8.1/src/common/splines.F /build/cp2k-Q381vr/cp2k-8.1/src/common/string_utilities.F /build/cp2k-Q381vr/cp2k-8.1/src/common/timings.F /build/cp2k-Q381vr/cp2k-8.1/src/common/bibliography.F /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_min_heap.F /build/cp2k-Q381vr/cp2k-8.1/src/common/structure_factors.F /build/cp2k-Q381vr/cp2k-8.1/src/common/periodic_table.F /build/cp2k-Q381vr/cp2k-8.1/src/common/fparser.F /build/cp2k-Q381vr/cp2k-8.1/src/common/mathconstants.F /build/cp2k-Q381vr/cp2k-8.1/src/common/list_routinestat.F /build/cp2k-Q381vr/cp2k-8.1/src/common/parallel_rng_types_unittest.F /build/cp2k-Q381vr/cp2k-8.1/src/common/memory_utilities.F /build/cp2k-Q381vr/cp2k-8.1/src/common/linear_systems.F /build/cp2k-Q381vr/cp2k-8.1/src/common/physcon.F /build/cp2k-Q381vr/cp2k-8.1/src/common/gamma.F /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_para_types.F /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_files.F /build/cp2k-Q381vr/cp2k-8.1/src/common/t_c_g0.F /build/cp2k-Q381vr/cp2k-8.1/src/common/whittaker.F /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_units.F /build/cp2k-Q381vr/cp2k-8.1/src/common/list_callstackentry.F /build/cp2k-Q381vr/cp2k-8.1/src/common/timings_base_type.F /build/cp2k-Q381vr/cp2k-8.1/src/common/structure_factor_types.F /build/cp2k-Q381vr/cp2k-8.1/src/common/print_messages.F /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_error_handling.F /build/cp2k-Q381vr/cp2k-8.1/src/common/timings_types.F /build/cp2k-Q381vr/cp2k-8.1/src/common/lebedev.F /build/cp2k-Q381vr/cp2k-8.1/src/common/list.F /build/cp2k-Q381vr/cp2k-8.1/src/common/util.F /build/cp2k-Q381vr/cp2k-8.1/src/common/powell.F /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_result_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_array_sort.F /build/cp2k-Q381vr/cp2k-8.1/src/common/memory_utilities_unittest.F /build/cp2k-Q381vr/cp2k-8.1/src/common/list_timerenv.F /build/cp2k-Q381vr/cp2k-8.1/src/common/cuda_profiling.F /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_log_handling.F /build/cp2k-Q381vr/cp2k-8.1/src/common/d3_poly.F /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_result_types.F /build/cp2k-Q381vr/cp2k-8.1/src/common/eigenvalueproblems.F /build/cp2k-Q381vr/cp2k-8.1/src/common/parallel_rng_types.F /build/cp2k-Q381vr/cp2k-8.1/src/common/spherical_harmonics.F /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_iter_types.F /build/cp2k-Q381vr/cp2k-8.1/src/common/t_sh_p_s_c.F /build/cp2k-Q381vr/cp2k-8.1/src/common/callgraph.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_embed.F /build/cp2k-Q381vr/cp2k-8.1/src/group_dist_types.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_mp2.F /build/cp2k-Q381vr/cp2k-8.1/src/fist_intra_force.F /build/cp2k-Q381vr/cp2k-8.1/src/pw_poisson_read_input.F /build/cp2k-Q381vr/cp2k-8.1/src/pao_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/fist_nonbond_force.F /build/cp2k-Q381vr/cp2k-8.1/src/pexsi_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_pdos.F /build/cp2k-Q381vr/cp2k-8.1/src/hfx_screening_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_fermi_contact.F /build/cp2k-Q381vr/cp2k-8.1/src/nnp_force.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_thermostats.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_interactions.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_subsys_types.F /build/cp2k-Q381vr/cp2k-8.1/src/free_energy_types.F /build/cp2k-Q381vr/cp2k-8.1/src/wannier_states.F /build/cp2k-Q381vr/cp2k-8.1/src/atom_energy.F /build/cp2k-Q381vr/cp2k-8.1/src/particle_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/localization_tb.F /build/cp2k-Q381vr/cp2k-8.1/src/pexsi_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_local_rho_types.F /build/cp2k-Q381vr/cp2k-8.1/src/uff_vdw_radii_table.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_loc.F /build/cp2k-Q381vr/cp2k-8.1/src/pme_tools.F /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_ic.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_csr_write.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_restart.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_matrices.F /build/cp2k-Q381vr/cp2k-8.1/src/se_fock_matrix.F /build/cp2k-Q381vr/cp2k-8.1/src/mp2_direct_method.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_binary_restarts.F /build/cp2k-Q381vr/cp2k-8.1/src/mscfg_types.F /build/cp2k-Q381vr/cp2k-8.1/src/splines_types.F /build/cp2k-Q381vr/cp2k-8.1/src/xtb_ehess.F /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_analysis_types.F /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_setup.F /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_file_io.F /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_moves.F /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_tree_types.F /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_tree_search.F /build/cp2k-Q381vr/cp2k-8.1/src/tmc/input_cp2k_tmc.F /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_tree_build.F /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_calculations.F /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_tree_acceptance.F /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_stati.F /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_master.F /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_cancelation.F /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_types.F /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_messages.F /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_move_types.F /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_worker.F /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_tree_references.F /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_dot_tree.F /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_move_handle.F /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_analysis.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmmx_create.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy_types.F /build/cp2k-Q381vr/cp2k-8.1/src/generic_os_integrals.F /build/cp2k-Q381vr/cp2k-8.1/src/fist_environment.F /build/cp2k-Q381vr/cp2k-8.1/src/et_coupling_types.F /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_buffer_types.F /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/input/input_enumeration_types.F /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_status_types.F /build/cp2k-Q381vr/cp2k-8.1/src/input/input_parsing.F /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_output_handling.F /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_inpp_types.F /build/cp2k-Q381vr/cp2k-8.1/src/input/input_val_types.F /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_linked_list_input.F /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_inpp_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/input/input_section_types.F /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_ilist_types.F /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_types.F /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_ilist_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/input/input_keyword_types.F /build/cp2k-Q381vr/cp2k-8.1/src/topology_constraint_util.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_integrate_potential_single.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_qmmm.F /build/cp2k-Q381vr/cp2k-8.1/src/statistical_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/topology_multiple_unit_cell.F /build/cp2k-Q381vr/cp2k-8.1/src/atom_grb.F /build/cp2k-Q381vr/cp2k-8.1/src/mixed_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/src/se_core_matrix.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/metadynamics.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_p_env_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/hfx_pw_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_nonloc.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_basis_gradient.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_external.F /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rkinetic.F /build/cp2k-Q381vr/cp2k-8.1/src/preconditioner_solvers.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_resp.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_types.F /build/cp2k-Q381vr/cp2k-8.1/src/xc_write_output.F /build/cp2k-Q381vr/cp2k-8.1/src/sap_kind_types.F /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri_gpw.F /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/ct_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/force_fields_util.F /build/cp2k-Q381vr/cp2k-8.1/src/cp_dbcsr_output.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_util.F /build/cp2k-Q381vr/cp2k-8.1/src/pao_linpot_rotinv.F /build/cp2k-Q381vr/cp2k-8.1/src/topology_xyz.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_diagonalization.F /build/cp2k-Q381vr/cp2k-8.1/src/embed_types.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_check.F /build/cp2k-Q381vr/cp2k-8.1/src/atom_fit.F /build/cp2k-Q381vr/cp2k-8.1/src/force_field_types.F /build/cp2k-Q381vr/cp2k-8.1/src/atom_pseudo.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_external_density.F /build/cp2k-Q381vr/cp2k-8.1/src/dbcsrx/dbcsr_vector.F /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_chargemol.F /build/cp2k-Q381vr/cp2k-8.1/src/admm_dm_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/pao_main.F /build/cp2k-Q381vr/cp2k-8.1/src/mp2_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy.F /build/cp2k-Q381vr/cp2k-8.1/src/fist_nonbond_env_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_filter_matrix_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_atom.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_buffer_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf.F /build/cp2k-Q381vr/cp2k-8.1/src/xc_adiabatic_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_parameters.F /build/cp2k-Q381vr/cp2k-8.1/src/xc_pot_saop.F /build/cp2k-Q381vr/cp2k-8.1/src/hartree_local_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/lri_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_dispersion.F /build/cp2k-Q381vr/cp2k-8.1/src/input_optimize_basis.F /build/cp2k-Q381vr/cp2k-8.1/src/topology_input.F /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_ff_fist.F /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_neb.F /build/cp2k-Q381vr/cp2k-8.1/src/start/libcp2k_unittest.c /build/cp2k-Q381vr/cp2k-8.1/src/grid/hybrid/grid_collocate_hybrid.c /build/cp2k-Q381vr/cp2k-8.1/src/grid/hybrid/grid_integrate_hybrid.c /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_prepare_pab.c /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_task_list.c /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_integrate.c /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_collocate.c /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_replay.c /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_unittest.c /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_miniapp.c /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.c /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.c /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_sphere_cache.c /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_library.c /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_prepare_pab_dgemm.c /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/non_orthorombic_corrections.c /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_integrate_dgemm.c /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_context_cpu.c /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/coefficients.c /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.c /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_collocate_dgemm.c /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/tensor_local.c /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/collocation_integration.c /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_task_list.c /build/cp2k-Q381vr/cp2k-8.1/src/pw/fpga/fft_fpga.c /build/cp2k-Q381vr/cp2k-8.1/src/pw/fpga/opencl_utils.c /build/cp2k-Q381vr/cp2k-8.1/src/base/machine_cpuid.c /build/cp2k-Q381vr/cp2k-8.1/src/sockets.c /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_data_manipulation.f90 /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_data_selection.f90 /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_debug.f90 /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90 /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_args.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/machine_posix.f90 /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90 /build/cp2k-Q381vr/cp2k-8.1/src/call_integrate.f90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_f77_methods.f90 /build/cp2k-Q381vr/cp2k-8.1/src/common/sort_m.f90 /build/cp2k-Q381vr/cp2k-8.1/src/dbcsrx/hash_table_types.f90 /build/cp2k-Q381vr/cp2k-8.1/src/dbcsrx/hash_table.f90 /build/cp2k-Q381vr/cp2k-8.1/src/start/libcp2k.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_replay.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/hybrid/hybrid_private_header.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/hybrid/grid_integrate_cuda.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/hybrid/grid_collocate_hybrid.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/hybrid/grid_hybrid_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_collocate.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_prepare_pab.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_integrate.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_collint.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/gpu/grid_gpu_collint.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/gpu/grid_gpu_integrate.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/gpu/grid_gpu_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/gpu/grid_gpu_collocate.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_library.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_process_vab.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_prepare_pab.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/non_orthorombic_corrections.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/collocation_integration.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_context_cpu.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_prepare_pab_dgemm.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/tensor_local.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/coefficients.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_collocate_dgemm.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_cpu_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/pw/fpga/fft_fpga.h /build/cp2k-Q381vr/cp2k-8.1/src/pw/fpga/opencl_utils.h /build/cp2k-Q381vr/cp2k-8.1/src/pw/cuda/fft_cuda_internal.h /build/cp2k-Q381vr/cp2k-8.1/src/pw/cuda/pw_cuda_utils.h /build/cp2k-Q381vr/cp2k-8.1/src/pw/cuda/fft_cuda.h /build/cp2k-Q381vr/cp2k-8.1/src/pw/cuda/fft_cuda_utils.h /build/cp2k-Q381vr/cp2k-8.1/src/pw/cuda/pw_cuda.h /build/cp2k-Q381vr/cp2k-8.1/src/base/machine_cpuid.h /build/cp2k-Q381vr/cp2k-8.1/src/pw_env/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/swarm/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/emd/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/minimax/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/hfxbase/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/start/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/fm/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/xc/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/grid/hybrid/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/grid/gpu/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/grid/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/shg_int/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/pw/fpga/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/pw/cuda/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/pw/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/base/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/motion/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/subsys/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/common/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/tmc/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/input/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/dbcsrx/PACKAGE dirs echo "Removing stale archives for psmp ... " Removing stale archives for psmp ... /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/check_archives.py ar /build/cp2k-Q381vr/cp2k-8.1/src /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp echo "Resolving dependencies for psmp ... " Resolving dependencies for psmp ... /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/makedep.py /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/all.dep cp2k "lower" "normal" .a /build/cp2k-Q381vr/cp2k-8.1/src ./lri_ks_methods.F ./kg_environment_types.F ./semi_empirical_int_utils.F ./grrm_utils.F ./input_cp2k_eip.F ./qs_diis_types.F ./qs_scf_initialization.F ./ewald_methods_tb.F ./hfx_pair_list_methods.F ./qs_fb_distribution_methods.F ./qs_scf_post_scf.F ./qs_core_energies.F ./manybody_tersoff.F ./mao_basis.F ./qmmm_gaussian_data.F ./qs_ot_types.F ./qs_sccs.F ./qs_update_s_mstruct.F ./qs_fb_atomic_halo_types.F ./qs_rho0_types.F ./preconditioner_apply.F ./fist_efield_methods.F ./qs_efield_local.F ./iterate_matrix.F ./core_ppnl.F ./dm_ls_scf_create.F ./constraint_vsite.F ./qs_rho_atom_types.F ./qs_rho_methods.F ./pw_env/pw_env_types.F ./pw_env/cp_spline_utils.F ./pw_env/rs_pw_interface.F ./pw_env/gaussian_gridlevels.F ./kpoint_io.F ./arnoldi/arnoldi_data_methods.F ./arnoldi/arnoldi_api.F ./arnoldi/arnoldi_geev.F ./arnoldi/arnoldi_methods.F ./arnoldi/arnoldi_types.F ./qs_loc_types.F ./qs_energy_init.F ./almo_scf_env_methods.F ./pao_potentials.F ./submatrix_types.F ./input_cp2k_free_energy.F ./cp_external_control.F ./qs_ks_apply_restraints.F ./xas_tdp_correction.F ./xas_tdp_utils.F ./pexsi_interface.F ./pair_potential_types.F ./qs_ks_qmmm_types.F ./semi_empirical_mpole_types.F ./qs_grid_atom.F ./swarm/swarm_master.F ./swarm/swarm_input.F ./swarm/glbopt_history.F ./swarm/swarm_message.F ./swarm/swarm_mpi.F ./swarm/glbopt_mincrawl.F ./swarm/glbopt_minhop.F ./swarm/glbopt_input.F ./swarm/swarm.F ./swarm/swarm_worker.F ./swarm/glbopt_worker.F ./swarm/glbopt_master.F ./qs_dftb_utils.F ./qs_efield_berry.F ./qs_linres_issc_utils.F ./eri_mme/eri_mme_integrate.F ./eri_mme/eri_mme_types.F ./eri_mme/eri_mme_error_control.F ./eri_mme/eri_mme_test.F ./eri_mme/eri_mme_gaussian.F ./eri_mme/eri_mme_util.F ./eri_mme/eri_mme_lattice_summation.F ./mp2.F ./taper_types.F ./cp2k_debug.F ./qs_kpp1_env_types.F ./pao_ml_gaussprocess.F ./input_cp2k_ec.F ./qs_ot.F ./qs_electric_field_gradient.F ./negf_green_methods.F ./qs_tddfpt_eigensolver.F ./stm_images.F ./preconditioner.F ./qmmm_gpw_forces.F ./lri_optimize_ri_basis.F ./ec_efield_local.F ./force_env_utils.F ./qs_tddfpt2_densities.F ./farming_types.F ./maxwell_solver_interface.F ./xtb_parameters.F ./qs_environment_methods.F ./se_fock_matrix_dbg.F ./topology.F ./topology_gromos.F ./manybody_eam.F ./cp_realspace_grid_init.F ./qs_linres_module.F ./qs_gcp_utils.F ./semi_empirical_int_arrays.F ./xtb_types.F ./emd/rt_propagation_methods.F ./emd/rt_propagator_init.F ./emd/rt_delta_pulse.F ./emd/rt_hfx_utils.F ./emd/rt_make_propagators.F ./emd/rt_propagation_output.F ./emd/rt_propagation_utils.F ./negf_alloc_types.F ./qs_o3c_methods.F ./rmsd.F ./hartree_local_types.F ./preconditioner_types.F ./semi_empirical_int_ana.F ./mixed_cdft_types.F ./qs_ks_atom.F ./input_cp2k_mm.F ./fp_types.F ./qs_ot_eigensolver.F ./auto_basis.F ./optimize_basis_utils.F ./ec_environment.F ./constraint_4x6.F ./hirshfeld_methods.F ./pao_ml_descriptor.F ./rt_propagation_types.F ./semi_empirical_int_num.F ./subcell_types.F ./qs_rho0_methods.F ./dm_ls_scf_curvy.F ./lri_compression.F ./minimax/minimax_exp_k15.F ./minimax/minimax_rpa.F ./minimax/minimax_exp.F ./minimax/minimax_exp_gw.F ./minimax/minimax_exp_k53.F ./aobasis/ai_operators_r12.F ./aobasis/ai_coulomb_test.F ./aobasis/ai_overlap_aabb.F ./aobasis/basis_set_container_types.F ./aobasis/ai_elec_field.F ./aobasis/ai_overlap.F ./aobasis/ai_os_rr.F ./aobasis/ai_verfc.F ./aobasis/ai_overlap3_debug.F ./aobasis/sto_ng.F ./aobasis/ao_util.F ./aobasis/ai_derivatives.F ./aobasis/ai_overlap3.F ./aobasis/ai_contraction_sphi.F ./aobasis/orbital_symbols.F ./aobasis/ai_moments.F ./aobasis/ai_coulomb.F ./aobasis/ai_eri_debug.F ./aobasis/soft_basis_set.F ./aobasis/ai_angmom.F ./aobasis/ai_kinetic.F ./aobasis/ai_overlap_debug.F ./aobasis/ai_oneelectron.F ./aobasis/orbital_pointers.F ./aobasis/ai_overlap_ppl.F ./aobasis/basis_set_types.F ./aobasis/orbital_transformation_matrices.F ./aobasis/aux_basis_set.F ./aobasis/ai_fermi_contact.F ./aobasis/ai_spin_orbit.F ./aobasis/ai_onecenter.F ./aobasis/ai_contraction.F ./aobasis/ai_operator_ra2m.F ./fist_neighbor_lists.F ./bse.F ./qs_scf_block_davidson.F ./molden_utils.F ./hfxbase/hfx_contraction_methods.F ./hfxbase/hfx_compression_core_methods.F ./hfxbase/hfx_contract_block.F ./atom_xc.F ./replica_methods.F ./optbas_opt_utils.F ./lri_integrals.F ./motion_utils.F ./nnp_model.F ./libint_wrapper.F ./input_optimize_input.F ./qs_dispersion_types.F ./cp_control_types.F ./mp2_optimize_ri_basis.F ./ewald_environment_types.F ./se_fock_matrix_exchange.F ./qs_kinetic.F ./pw_env_methods.F ./qs_scf_loop_utils.F ./ewald_pw_methods.F ./fist_neighbor_list_control.F ./atom_utils.F ./input_cp2k_global.F ./dft_plus_u.F ./molsym.F ./response_solver.F ./mao_types.F ./external_potential_methods.F ./rpa_kpoints.F ./virial_methods.F ./qs_fb_hash_table_types.F ./qs_dispersion_pairpot.F ./xas_tp_scf.F ./atom_optimization.F ./input_cp2k_colvar.F ./qmmmx_types.F ./cp_ddapc_types.F ./cell_methods.F ./qs_nl_hash_table_types.F ./qs_mo_methods.F ./qs_mo_io.F ./matrix_exp.F ./mixed_cdft_utils.F ./almo_scf_lbfgs_types.F ./qs_subsys_methods.F ./ewald_pw_types.F ./semi_empirical_int_debug.F ./qs_integrate_potential.F ./semi_empirical_parameters.F ./input_cp2k_atprop.F ./negf_env_types.F ./pair_potential.F ./transport_env_types.F ./library_tests.F ./optbas_fenv_manipulation.F ./qmmm_per_elpot.F ./start/libcp2k.F ./start/input_cp2k_motion.F ./start/cp2k.F ./start/cp2k_runs.F ./start/cp2k_shell.F ./start/input_cp2k.F ./xas_tdp_atom.F ./cp_eri_mme_interface.F ./qs_fb_env_methods.F ./fm/cp_fm_cholesky.F ./fm/cp_fm_pool_types.F ./fm/cp_fm_struct.F ./fm/cp_fm_diag_utils.F ./fm/cp_fm_vect.F ./fm/cp_blacs_calls.F ./fm/cp_fm_diag.F ./fm/cp_cfm_types.F ./fm/cp_fm_elpa.F ./fm/cp_linked_list_fm.F ./fm/cp_cfm_basic_linalg.F ./fm/cp_cfm_diag.F ./fm/cp_blacs_env.F ./fm/cp_fm_basic_linalg.F ./fm/cp_fm_types.F ./xas_restart.F ./qs_linres_types.F ./input_cp2k_dft.F ./replica_types.F ./mp2_ri_grad.F ./cryssym.F ./qs_linres_nmr_epr_common_utils.F ./almo_scf_diis_types.F ./pwdft_environment.F ./pao_param.F ./splines_methods.F ./metadynamics_types.F ./qs_o3c_types.F ./simpar_types.F ./qs_diis.F ./qs_ks_types.F ./qs_gspace_mixing.F ./admm_types.F ./block_p_types.F ./topology_generate_util.F ./spglib_f08.F ./qmmm_gpw_energy.F ./qmmm_gaussian_types.F ./mpiwrap/message_passing.F ./mao_optimizer.F ./negf_control_types.F ./qs_force_types.F ./qmmm_gaussian_input.F ./qmmm_types_low.F ./mm_collocate_potential.F ./optimize_basis.F ./molecular_states.F ./negf_integr_cc.F ./fist_force.F ./force_fields_ext.F ./atom.F ./minbas_methods.F ./almo_scf_qs.F ./manybody_gal.F ./pao_input.F ./input_constants.F ./mm_mapping_library.F ./pao_ml_neuralnet.F ./mp2_ri_gpw.F ./atom_upf.F ./qs_ks_utils.F ./qs_gapw_densities.F ./qs_ot_scf.F ./et_coupling.F ./force_fields_input.F ./se_fock_matrix_coulomb.F ./input_cp2k_negf.F ./qs_fb_com_tasks_types.F ./kg_correction.F ./pme.F ./input_cp2k_pwdft.F ./qs_integrate_potential_product.F ./qs_overlap.F ./hfx_communication.F ./se_core_core.F ./qs_dftb_coulomb.F ./topology_connectivity_util.F ./bsse.F ./qs_density_mixing_types.F ./kpoint_coulomb_2c.F ./qmmm_image_charge.F ./dm_ls_chebyshev.F ./qs_linres_current_utils.F ./qs_localization_methods.F ./optimize_embedding_potential.F ./beta_gamma_psi.F ./topology_coordinate_util.F ./semi_empirical_int3_utils.F ./qs_tddfpt2_operators.F ./input_cp2k_subsys.F ./input_restart_force_eval.F ./qs_p_env_types.F ./rpa_rse.F ./lri_optimize_ri_basis_types.F ./qs_condnum.F ./qs_linres_nmr_shift.F ./input_cp2k_tb.F ./force_env_methods.F ./atom_admm_methods.F ./input_restart_rng.F ./input_cp2k_hfx.F ./kg_environment.F ./qs_tddfpt2_eigensolver.F ./semi_empirical_expns3_methods.F ./pao_io.F ./lri_environment_methods.F ./extended_system_types.F ./environment.F ./qs_active_space_types.F ./xc/xc_xbr_pbe_lda_hole_t_c_lr.F ./xc/xc_derivative_types.F ./xc/xc_tpss.F ./xc/xc_lyp_adiabatic.F ./xc/xc_rho_cflags_types.F ./xc/xc_optx.F ./xc/xc_perdew_wang.F ./xc/xc_xalpha.F ./xc/xc_b97.F ./xc/xc_cs1.F ./xc/xc_xbecke88_lr_adiabatic.F ./xc/xc_derivatives.F ./xc/xc_libxc_wrap.F ./xc/xc_xbecke88.F ./xc/xc_xwpbe.F ./xc/xc_sr_lda.F ./xc/xc_atom.F ./xc/xc_perdew86.F ./xc/xc_rho_set_types.F ./xc/xc_xbecke_roussel.F ./xc/xc_vwn.F ./xc/xc_exchange_gga.F ./xc/xc_pade.F ./xc/xc_lyp.F ./xc/xc_libxc.F ./xc/xc_pbe.F ./xc/xc_thomas_fermi.F ./xc/xc_xlda_hole_t_c_lr.F ./xc/xc_xbeef.F ./xc/xc_hcth.F ./xc/xc_functionals_utilities.F ./xc/cp_linked_list_xc_deriv.F ./xc/xc.F ./xc/xc_xpbe_hole_t_c_lr.F ./xc/xc_ke_gga.F ./xc/xc_derivative_set_types.F ./xc/xc_tfw.F ./xc/xc_xbecke88_long_range.F ./xc/xc_derivative_desc.F ./xc/xc_perdew_zunger.F ./xc/xc_input_constants.F ./task_list_methods.F ./qs_fb_input.F ./negf_methods.F ./submatrix_dissection.F ./lri_environment_init.F ./qs_dos.F ./qs_period_efield_types.F ./shg_integrals_test.F ./qs_ks_methods.F ./distribution_2d_types.F ./wannier_states_types.F ./qs_collocate_density.F ./qs_fb_trial_fns_types.F ./qs_dispersion_utils.F ./pwdft_environment_types.F ./qs_dftb_types.F ./qs_vxc.F ./qs_outer_scf.F ./qs_scf_post_se.F ./eip_environment_types.F ./atom_electronic_structure.F ./qs_wf_history_methods.F ./mode_selective.F ./mp2_ri_grad_util.F ./mp2_ri_2c.F ./topology_xtl.F ./mixed_energy_types.F ./ewalds_multipole.F ./qs_loc_states.F ./qs_integral_utils.F ./qs_energy_window.F ./mp2_gpw.F ./efield_tb_methods.F ./qs_mom_types.F ./negf_vectors.F ./constraint_fxd.F ./qs_linres_epr_utils.F ./qs_tddfpt2_methods.F ./qs_dftb3_methods.F ./pair_potential_coulomb.F ./rel_control_types.F ./surface_dipole.F ./qs_loc_utils.F ./topology_pdb.F ./grid/grid_api.F ./input_cp2k_constraints.F ./pao_types.F ./fist_environment_types.F ./hfx_derivatives.F ./rpa_im_time.F ./constraint_clv.F ./qs_core_hamiltonian.F ./input_cp2k_kpoints.F ./hfx_compression_methods.F ./qs_external_potential.F ./domain_submatrix_types.F ./topology_psf.F ./input_cp2k_field.F ./atom_sgp.F ./pair_potential_util.F ./mp2_integrals.F ./qs_loc_dipole.F ./qs_resp.F ./mulliken.F ./constraint_util.F ./voronoi_interface.F ./cp_dbcsr_cp2k_link.F ./exclusion_types.F ./shg_int/generic_shg_integrals_init.F ./shg_int/s_contract_shg.F ./shg_int/constants_operator.F ./shg_int/generic_shg_integrals.F ./shg_int/construct_shg.F ./negf_atom_map.F ./input_cp2k_force_eval.F ./force_fields_all.F ./negf_integr_simpson.F ./cp_gemm_interface.F ./input_cp2k_xc.F ./fermi_utils.F ./pw/dielectric_types.F ./pw/dct.F ./pw/dgs.F ./pw/ps_wavelet_kernel.F ./pw/fft_tools.F ./pw/ps_wavelet_methods.F ./pw/dg_rho0_types.F ./pw/rs_methods.F ./pw/cube_utils.F ./pw/pw_methods.F ./pw/dg_types.F ./pw/mt_util.F ./pw/lazy.F ./pw/pw_types.F ./pw/realspace_grid_cube.F ./pw/ps_wavelet_types.F ./pw/pw_grid_info.F ./pw/pw_spline_utils.F ./pw/dielectric_methods.F ./pw/ps_wavelet_fft3d.F ./pw/pw_grids.F ./pw/realspace_grid_types.F ./pw/pw_grid_types.F ./pw/ps_wavelet_scaling_function.F ./pw/pw_pool_types.F ./pw/ps_implicit_types.F ./pw/pw_fpga.F ./pw/ps_wavelet_base.F ./pw/ps_implicit_methods.F ./pw/cp_linked_list_pw.F ./pw/dirichlet_bc_types.F ./pw/pw_poisson_methods.F ./pw/pw_cuda.F ./pw/fast.F ./pw/pw_poisson_types.F ./pw/ps_wavelet_util.F ./pw/fft/fft_kinds.F ./pw/fft/fftsg_lib.F ./pw/fft/fft_plan.F ./pw/fft/fft_lib.F ./pw/fft/fftw3_lib.F ./pw/fft/mltfftsg_tools.F ./pw/dirichlet_bc_methods.F ./pao_linpot_full.F ./constraint.F ./constraint_3x3.F ./fist_main.F ./input_cp2k_properties_dft.F ./qs_tddfpt2_properties.F ./rpa_communication.F ./qmmmx_update.F ./qs_cdft_scf_utils.F ./qmmmx_util.F ./optimize_input.F ./qs_gcp_method.F ./ewalds.F ./fist_pol_scf.F ./qs_commutators.F ./core_ppl.F ./qs_scf_wfn_mix.F ./hfx_admm_utils.F ./topology_cif.F ./mp2_gpw_method.F ./cp_ddapc_methods.F ./integration_grid_types.F ./mao_wfn_analysis.F ./qs_gamma2kp.F ./atom_basis.F ./negf_matrix_utils.F ./qs_environment_types.F ./dkh_main.F ./scf_control_types.F ./qs_moments.F ./mp2_ri_libint.F ./domain_submatrix_methods.F ./qs_cdft_types.F ./qs_cdft_methods.F ./ct_types.F ./qs_scf_methods.F ./embed_environment.F ./qs_mixing_utils.F ./colvar_methods.F ./xas_env_types.F ./outer_scf_control_types.F ./nnp_acsf.F ./metadyn_tools/graph_methods.F ./metadyn_tools/graph_utils.F ./metadyn_tools/graph.F ./xas_tdp_kernel.F ./eip_environment.F ./embed_main.F ./negf_integr_utils.F ./input_cp2k_mixed.F ./molecular_dipoles.F ./basis_set_output.F ./qs_rho_types.F ./kpoint_transitional.F ./qs_fb_env_types.F ./qs_scf_post_tb.F ./cp_realspace_grid_cube.F ./qs_gcp_types.F ./admm_utils.F ./lri_forces.F ./rpa_gw_kpoints.F ./gle_system_types.F ./semi_empirical_mpole_methods.F ./cp_symmetry.F ./qs_fb_atomic_matrix_methods.F ./pao_param_linpot.F ./input_cp2k_transport.F ./kg_tnadd_mat.F ./se_fock_matrix_integrals.F ./xas_tdp_types.F ./manybody_potential.F ./fist_energy_types.F ./qs_mo_types.F ./qs_cdft_utils.F ./qmmm_init.F ./semi_empirical_integrals.F ./cp_dbcsr_diag.F ./task_list_types.F ./qs_linres_epr_nablavks.F ./cp_control_utils.F ./mdctrl_types.F ./kpoint_types.F ./qs_linres_methods.F ./ri_environment_methods.F ./qs_elf_methods.F ./rpa_util.F ./force_env_types.F ./qs_linres_nmr_utils.F ./xas_tdp_integrals.F ./hfx_helpers.F ./input_cp2k_ls.F ./qs_mom_methods.F ./qs_environment.F ./qs_vxc_atom.F ./qs_ot_minimizer.F ./qs_band_structure.F ./mp2_grids.F ./rt_propagation_forces.F ./qs_active_space_methods.F ./mp2_eri.F ./atom_kind_orbitals.F ./qmmm_tb_coulomb.F ./base/machine.F ./base/kinds.F ./base/base_hooks.F ./base/machine_internal.F ./sirius_interface.F ./qs_loc_molecules.F ./qs_linres_epr_ownutils.F ./eip_silicon.F ./optimize_dmfet_potential.F ./qs_force.F ./cp_ddapc_forces.F ./semi_empirical_par_utils.F ./semi_empirical_utils.F ./energy_corrections.F ./topology_util.F ./preconditioner_makes.F ./qs_charge_mixing.F ./admm_dm_types.F ./qs_rho_atom_methods.F ./qmmm_force.F ./cp_ddapc.F ./negf_subgroup_types.F ./qs_linres_polar_utils.F ./libint_2c_3c.F ./semi_empirical_store_int_types.F ./xas_methods.F ./hfx_types.F ./pao_param_fock.F ./xas_control.F ./dm_ls_scf.F ./qmmm_se_energy.F ./population_analyses.F ./mixed_main.F ./qmmm_elpot.F ./qs_oce_types.F ./manybody_siepmann.F ./topology_types.F ./qs_scf_types.F ./f77_interface.F ./hfx_ri.F ./qs_block_davidson_types.F ./mscfg_methods.F ./mp2_cphf.F ./colvar_utils.F ./pilaenv_hack.F ./almo_scf.F ./qs_neighbor_list_types.F ./hirshfeld_types.F ./pao_optimizer.F ./fp_methods.F ./qs_linres_current.F ./ec_env_types.F ./qs_tddfpt2_utils.F ./qmmm_gaussian_init.F ./force_fields.F ./topology_cp2k.F ./qmmm_tb_methods.F ./efield_utils.F ./input_cp2k_restarts_util.F ./spme.F ./qs_wf_history_types.F ./global_types.F ./qs_kpp1_env_methods.F ./qs_scf_output.F ./qs_scf_lanczos.F ./farming_methods.F ./topology_amber.F ./qs_linres_atom_current.F ./mp2_setup.F ./pao_param_gth.F ./scine_utils.F ./qs_epr_hyp.F ./semi_empirical_int_gks.F ./optimize_basis_types.F ./semi_empirical_types.F ./qs_neighbor_lists.F ./qs_tddfpt_utils.F ./qs_tddfpt2_stda_utils.F ./nnp_environment.F ./qs_cdft_opt_types.F ./mol_force.F ./wannier90.F ./fist_efield_types.F ./input_cp2k_nnp.F ./cp_dbcsr_cholesky.F ./al_system_types.F ./xtb_matrices.F ./qs_matrix_pools.F ./fist_neighbor_list_types.F ./kpoint_methods.F ./atom_operators.F ./core_ae.F ./qs_oce_methods.F ./mixed_environment.F ./ls_matrix_exp.F ./qs_ks_qmmm_methods.F ./atomic_charges.F ./cp2k_info.F ./xtb_coulomb.F ./ipi_driver.F ./xc_adiabatic_utils.F ./debug_os_integrals.F ./qs_mo_occupation.F ./qs_tensors_types.F ./qs_elec_field.F ./moments_utils.F ./hfx_load_balance_methods.F ./motion/helium_types.F ./motion/dimer_utils.F ./motion/reftraj_util.F ./motion/md_run.F ./motion/pint_public.F ./motion/gopt_param_types.F ./motion/dimer_types.F ./motion/pint_methods.F ./motion/gopt_f_types.F ./motion/mdctrl_methods.F ./motion/pint_io.F ./motion/vibrational_analysis.F ./motion/cell_opt_utils.F ./motion/thermostat/barostat_types.F ./motion/thermostat/thermostat_methods.F ./motion/thermostat/al_system_init.F ./motion/thermostat/csvr_system_dynamics.F ./motion/thermostat/thermostat_mapping.F ./motion/thermostat/extended_system_init.F ./motion/thermostat/gle_system_dynamics.F ./motion/thermostat/extended_system_mapping.F ./motion/thermostat/thermostat_types.F ./motion/thermostat/csvr_system_init.F ./motion/thermostat/input_cp2k_barostats.F ./motion/thermostat/extended_system_dynamics.F ./motion/thermostat/al_system_dynamics.F ./motion/thermostat/thermostat_utils.F ./motion/thermostat/csvr_system_mapping.F ./motion/thermostat/al_system_mapping.F ./motion/thermostat/barostat_utils.F ./motion/bfgs_optimizer.F ./motion/helium_methods.F ./motion/pint_normalmode.F ./motion/cg_optimizer.F ./motion/shell_opt.F ./motion/neb_io.F ./motion/simpar_methods.F ./motion/md_ener_types.F ./motion/dumpdcd.F ./motion/neb_opt_utils.F ./motion/cg_utils.F ./motion/input_cp2k_md.F ./motion/integrator_utils.F ./motion/free_energy_methods.F ./motion/dimer_methods.F ./motion/md_conserved_quantities.F ./motion/glbopt_callback.F ./motion/neb_methods.F ./motion/geo_opt.F ./motion/pint_types.F ./motion/helium_worm.F ./motion/helium_common.F ./motion/md_environment_types.F ./motion/cell_opt.F ./motion/velocity_verlet_control.F ./motion/wiener_process.F ./motion/neb_types.F ./motion/md_energies.F ./motion/gopt_f_methods.F ./motion/gopt_f77_methods.F ./motion/pint_transformations.F ./motion/averages_types.F ./motion/cell_opt_types.F ./motion/xyz2dcd.F ./motion/helium_sampling.F ./motion/neb_utils.F ./motion/helium_io.F ./motion/cp_lbfgs_geo.F ./motion/md_util.F ./motion/cp_lbfgs_optimizer_gopt.F ./motion/cp_lbfgs.F ./motion/reftraj_types.F ./motion/rt_propagation.F ./motion/pint_piglet.F ./motion/thermal_region_utils.F ./motion/pint_pile.F ./motion/pint_staging.F ./motion/neb_md_utils.F ./motion/md_vel_utils.F ./motion/pint_gle.F ./motion/thermal_region_types.F ./motion/input_cp2k_vib.F ./motion/mc/mc_run.F ./motion/mc/tamc_run.F ./motion/mc/mc_coordinates.F ./motion/mc/mc_types.F ./motion/mc/mc_ensembles.F ./motion/mc/mc_moves.F ./motion/mc/mc_move_control.F ./motion/mc/mc_environment_types.F ./motion/mc/mc_control.F ./motion/mc/mc_ge_moves.F ./motion/mc/mc_misc.F ./motion/input_cp2k_restarts.F ./motion/pint_qtb.F ./motion/integrator.F ./motion/helium_interactions.F ./input_cp2k_poisson.F ./restraint.F ./transport.F ./cp_ddapc_util.F ./qs_operators_ao.F ./subsys/shell_potential_types.F ./subsys/damping_dipole_types.F ./subsys/atprop_types.F ./subsys/external_potential_types.F ./subsys/atomic_kind_types.F ./subsys/molecule_list_types.F ./subsys/colvar_types.F ./subsys/molecule_types.F ./subsys/atomic_kind_list_types.F ./subsys/multipole_types.F ./subsys/cp_subsys_types.F ./subsys/particle_types.F ./subsys/particle_list_types.F ./subsys/molecule_kind_list_types.F ./subsys/force_field_kind_types.F ./subsys/molecule_kind_types.F ./subsys/cell_types.F ./subsys/virial_types.F ./qs_tddfpt2_fhxc.F ./s_square_methods.F ./qs_tddfpt2_stda_types.F ./almo_scf_types.F ./qs_fb_matrix_data_types.F ./qmmm_topology_util.F ./qs_hash_table_functions.F ./qs_tddfpt_types.F ./rtp_admm_methods.F ./dm_ls_scf_qs.F ./qs_initial_guess.F ./qs_kind_types.F ./distribution_methods.F ./csvr_system_types.F ./rpa_main.F ./rpa_gw.F ./qs_rho0_ggrid.F ./linesearch.F ./input_cp2k_read.F ./metadynamics_utils.F ./mao_methods.F ./atoms_input.F ./qmmmx_force.F ./atom_output.F ./negf_green_cache.F ./qs_wannier90.F ./qmmm_links_methods.F ./qs_local_properties.F ./input_cp2k_distribution.F ./input_cp2k_motion_print.F ./paw_proj_set_types.F ./qmmm_se_forces.F ./admm_methods.F ./commutator_rpnl.F ./qs_spin_orbit.F ./mixed_cdft_methods.F ./rpa_gw_im_time_util.F ./qs_tensors.F ./hfx_libint_interface.F ./almo_scf_optimizer.F ./qs_linres_op.F ./cp_subsys_methods.F ./qs_scf_post_gpw.F ./xray_diffraction.F ./ewald_spline_util.F ./qs_tddfpt2_subgroups.F ./almo_scf_methods.F ./header.F ./hfx_energy_potential.F ./cp_dbcsr_operations.F ./mixed_environment_utils.F ./dm_ls_scf_types.F ./input_cp2k_almo.F ./input_cp2k_rsgrid.F ./xas_tdp_methods.F ./semi_empirical_expns3_types.F ./qs_energy_matrix_w.F ./qmmm_create.F ./csvr_system_utils.F ./qs_harmonics_atom.F ./qmmm_pw_grid.F ./qs_charges_types.F ./qs_tddfpt_module.F ./manybody_quip.F ./minbas_wfn_analysis.F ./qs_energy_utils.F ./rpa_axk.F ./et_coupling_proj.F ./pao_param_exp.F ./graphcon.F ./molecular_moments.F ./mp2_laplace.F ./nnp_environment_types.F ./atom_types.F ./kg_vertex_coloring_methods.F ./common/timings_report.F ./common/distribution_1d_types.F ./common/cp_para_env.F ./common/bessel_lib.F ./common/lapack.F ./common/cg_test.F ./common/mathlib.F ./common/routine_map.F ./common/kahan_sum.F ./common/cp_array_utils.F ./common/reference_manager.F ./common/list_routinereport.F ./common/string_table.F ./common/splines.F ./common/string_utilities.F ./common/timings.F ./common/bibliography.F ./common/cp_min_heap.F ./common/structure_factors.F ./common/periodic_table.F ./common/fparser.F ./common/mathconstants.F ./common/list_routinestat.F ./common/parallel_rng_types_unittest.F ./common/memory_utilities.F ./common/linear_systems.F ./common/physcon.F ./common/gamma.F ./common/cp_para_types.F ./common/cp_files.F ./common/t_c_g0.F ./common/whittaker.F ./common/cp_units.F ./common/list_callstackentry.F ./common/timings_base_type.F ./common/structure_factor_types.F ./common/print_messages.F ./common/cp_error_handling.F ./common/timings_types.F ./common/lebedev.F ./common/list.F ./common/util.F ./common/powell.F ./common/cp_result_methods.F ./common/cp_array_sort.F ./common/memory_utilities_unittest.F ./common/list_timerenv.F ./common/cuda_profiling.F ./common/cp_log_handling.F ./common/d3_poly.F ./common/cp_result_types.F ./common/eigenvalueproblems.F ./common/parallel_rng_types.F ./common/spherical_harmonics.F ./common/cp_iter_types.F ./common/t_sh_p_s_c.F ./common/callgraph.F ./input_cp2k_embed.F ./group_dist_types.F ./input_cp2k_mp2.F ./fist_intra_force.F ./pw_poisson_read_input.F ./pao_methods.F ./fist_nonbond_force.F ./pexsi_methods.F ./qs_pdos.F ./hfx_screening_methods.F ./qs_fermi_contact.F ./nnp_force.F ./input_cp2k_thermostats.F ./qs_interactions.F ./qs_subsys_types.F ./free_energy_types.F ./wannier_states.F ./atom_energy.F ./particle_methods.F ./localization_tb.F ./pexsi_types.F ./qs_local_rho_types.F ./uff_vdw_radii_table.F ./input_cp2k_loc.F ./pme_tools.F ./rpa_gw_ic.F ./qs_scf_csr_write.F ./qs_tddfpt2_restart.F ./qs_dftb_matrices.F ./se_fock_matrix.F ./mp2_direct_method.F ./input_cp2k_binary_restarts.F ./mscfg_types.F ./splines_types.F ./xtb_ehess.F ./tmc/tmc_analysis_types.F ./tmc/tmc_setup.F ./tmc/tmc_file_io.F ./tmc/tmc_moves.F ./tmc/tmc_tree_types.F ./tmc/tmc_tree_search.F ./tmc/input_cp2k_tmc.F ./tmc/tmc_tree_build.F ./tmc/tmc_calculations.F ./tmc/tmc_tree_acceptance.F ./tmc/tmc_stati.F ./tmc/tmc_master.F ./tmc/tmc_utils.F ./tmc/tmc_cancelation.F ./tmc/tmc_types.F ./tmc/tmc_messages.F ./tmc/tmc_move_types.F ./tmc/tmc_worker.F ./tmc/tmc_tree_references.F ./tmc/tmc_dot_tree.F ./tmc/tmc_move_handle.F ./tmc/tmc_analysis.F ./qmmmx_create.F ./qs_energy_types.F ./generic_os_integrals.F ./fist_environment.F ./et_coupling_types.F ./input/cp_parser_buffer_types.F ./input/cp_parser_methods.F ./input/input_enumeration_types.F ./input/cp_parser_status_types.F ./input/input_parsing.F ./input/cp_output_handling.F ./input/cp_parser_inpp_types.F ./input/input_val_types.F ./input/cp_linked_list_input.F ./input/cp_parser_inpp_methods.F ./input/input_section_types.F ./input/cp_parser_ilist_types.F ./input/cp_parser_types.F ./input/cp_parser_ilist_methods.F ./input/input_keyword_types.F ./topology_constraint_util.F ./qs_tddfpt2_types.F ./qs_integrate_potential_single.F ./input_cp2k_qmmm.F ./statistical_methods.F ./topology_multiple_unit_cell.F ./atom_grb.F ./mixed_environment_types.F ./se_core_matrix.F ./qs_loc_methods.F ./metadynamics.F ./qs_p_env_methods.F ./hfx_pw_methods.F ./qs_dispersion_nonloc.F ./qs_basis_gradient.F ./input_cp2k_external.F ./commutator_rkinetic.F ./preconditioner_solvers.F ./input_cp2k_resp.F ./qmmm_types.F ./xc_write_output.F ./sap_kind_types.F ./mp2_eri_gpw.F ./dm_ls_scf_methods.F ./ct_methods.F ./force_fields_util.F ./cp_dbcsr_output.F ./qmmm_util.F ./pao_linpot_rotinv.F ./topology_xyz.F ./qs_scf_diagonalization.F ./embed_types.F ./input_cp2k_check.F ./atom_fit.F ./force_field_types.F ./atom_pseudo.F ./qs_external_density.F ./dbcsrx/dbcsr_vector.F ./pao_ml.F ./qs_chargemol.F ./admm_dm_methods.F ./pao_main.F ./mp2_types.F ./qs_energy.F ./fist_nonbond_env_types.F ./qs_fb_filter_matrix_methods.F ./input_cp2k_atom.F ./qs_fb_buffer_types.F ./qs_scf.F ./xc_adiabatic_methods.F ./qs_dftb_parameters.F ./xc_pot_saop.F ./hartree_local_methods.F ./lri_environment_types.F ./qs_dftb_dispersion.F ./input_optimize_basis.F ./topology_input.F ./qmmm_ff_fist.F ./input_cp2k_neb.F ./start/libcp2k_unittest.c ./grid/hybrid/grid_collocate_hybrid.c ./grid/hybrid/grid_integrate_hybrid.c ./grid/ref/grid_ref_prepare_pab.c ./grid/ref/grid_ref_task_list.c ./grid/ref/grid_ref_integrate.c ./grid/ref/grid_ref_collocate.c ./grid/grid_replay.c ./grid/grid_unittest.c ./grid/grid_miniapp.c ./grid/common/grid_basis_set.c ./grid/common/grid_buffer.c ./grid/common/grid_sphere_cache.c ./grid/common/grid_library.c ./grid/cpu/grid_prepare_pab_dgemm.c ./grid/cpu/non_orthorombic_corrections.c ./grid/cpu/grid_integrate_dgemm.c ./grid/cpu/grid_context_cpu.c ./grid/cpu/coefficients.c ./grid/cpu/utils.c ./grid/cpu/grid_collocate_dgemm.c ./grid/cpu/tensor_local.c ./grid/cpu/collocation_integration.c ./grid/grid_task_list.c ./pw/fpga/fft_fpga.c ./pw/fpga/opencl_utils.c ./base/machine_cpuid.c ./sockets.c /build/cp2k-Q381vr/cp2k-8.1/exts/Makefile.inc:16: target 'dbcsr' does not exist /usr/bin/make -C /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr -f .cp2k/Makefile \ INCLUDEMAKE=/build/cp2k-Q381vr/cp2k-8.1/arch/Linux-x86_64-gfortran.psmp \ LIBDIR=/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr \ OBJDIR=/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr \ ACC="" \ ACCFLAGS="" .cp2k/Makefile:209: target 'dirs' does not exist mkdir -p /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr mkdir -p /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr .cp2k/Makefile:248: update target 'makedep' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/work/dbcsr_work_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_util.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_methods.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/block/dbcsr_block_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/block/dbcsr_iterator_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/block/dbcsr_block_access.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/block/dbcsr_index_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_types.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_split.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_base.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_util.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_test.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_mm.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_reshape_ops.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_global.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_io.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_sched.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_hostdrv.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_dist_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_acc_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_csr.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_multiply_api.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_3d.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_accdrv.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_common.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_cannon.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_multrec.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_types.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_blas_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_toollib.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_min_heap.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_string_utilities.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_array_sort.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_files.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_btree.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_iter_types.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_methods.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_lib.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings_report.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_config.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_error_handling.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_print_messages.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_callstackentry.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_routinereport.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_timerenv.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_routinestat.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_types.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings_types.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings_base_type.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_dict.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_log_handling.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_array_types.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/dbcsr_api.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_hooks.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine_internal.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_kinds.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_devmem.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_stream.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_hostmem.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_event.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_device.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/cuda/dbcsr_cuda_profiling.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/hip/dbcsr_hipblas.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_init.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_timings.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mp_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mp_methods.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_methods_low.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_methods.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_types.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr_mem_methods.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr_ptr_util.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_array_list_methods.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_block.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_test.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_index.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_allocate_wrap.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_split.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_api.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_types.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_reshape.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_io.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_tests.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_io.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_transformations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_test_methods.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_csr_conversions.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/acc_bench_smm.c /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/acc_bench_trans.c /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_hash_table_types.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_hash_table.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine_posix.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/dbcsr.h /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/acc.h /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/acc_libsmm.h /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/libsmm_acc/libsmm_acc.h /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/libsmm_acc/libsmm_acc_init.h /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/libsmm_acc/parameters_utils.h /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/libsmm_acc/kernels/smm_acc_transpose.h /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/libsmm_acc/kernels/smm_acc_dnt_tiny.h /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/libsmm_acc/kernels/smm_acc_dnt_largeDB2.h /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/libsmm_acc/kernels/smm_acc_dnt_largeDB1.h /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/libsmm_acc/kernels/smm_acc_dnt_medium.h /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/libsmm_acc/kernels/smm_acc_common.h /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/libsmm_acc/kernels/smm_acc_dnt_small.h /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/libsmm_acc/libsmm_acc_benchmark.h /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/cuda/acc_cuda.h /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/cuda/acc_blas.h /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/cuda/acc_error.h /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/hip/acc_hip.h /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.h /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/work/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/dist/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/block/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/libsmm_acc/libcusmm/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/libsmm_acc/kernels/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/libsmm_acc/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/cuda/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/hip/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mpi/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/PACKAGE dirs echo "Removing stale archives ... " Removing stale archives ... python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/check_archives.py ar /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr echo "Resolving dependencies ... " Resolving dependencies ... python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/makedep.py /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/all.dep dbcsr "lower" "normal" .a /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src ./work/dbcsr_work_operations.F ./dist/dbcsr_dist_util.F ./dist/dbcsr_dist_operations.F ./dist/dbcsr_dist_methods.F ./block/dbcsr_block_operations.F ./block/dbcsr_iterator_operations.F ./block/dbcsr_block_access.F ./block/dbcsr_index_operations.F ./tas/dbcsr_tas_types.F ./tas/dbcsr_tas_split.F ./tas/dbcsr_tas_base.F ./tas/dbcsr_tas_util.F ./tas/dbcsr_tas_test.F ./tas/dbcsr_tas_mm.F ./tas/dbcsr_tas_reshape_ops.F ./tas/dbcsr_tas_global.F ./tas/dbcsr_tas_io.F ./mm/dbcsr_mm_sched.F ./mm/dbcsr_mm_hostdrv.F ./mm/dbcsr_mm_dist_operations.F ./mm/dbcsr_acc_operations.F ./mm/dbcsr_mm_csr.F ./mm/dbcsr_mm.F ./mm/dbcsr_multiply_api.F ./mm/dbcsr_mm_3d.F ./mm/dbcsr_mm_accdrv.F ./mm/dbcsr_mm_common.F ./mm/dbcsr_mm_cannon.F ./mm/dbcsr_mm_multrec.F ./mm/dbcsr_mm_types.F ./utils/dbcsr_blas_operations.F ./utils/dbcsr_toollib.F ./utils/dbcsr_min_heap.F ./utils/dbcsr_string_utilities.F ./utils/dbcsr_array_sort.F ./utils/dbcsr_files.F ./utils/dbcsr_btree.F ./core/dbcsr_iter_types.F ./core/dbcsr_methods.F ./core/dbcsr_lib.F ./core/dbcsr_timings_report.F ./core/dbcsr_config.F ./core/dbcsr_error_handling.F ./core/dbcsr_print_messages.F ./core/dbcsr_list_callstackentry.F ./core/dbcsr_list_routinereport.F ./core/dbcsr_list_timerenv.F ./core/dbcsr_timings.F ./core/dbcsr_list_routinestat.F ./core/dbcsr_list.F ./core/dbcsr_types.F ./core/dbcsr_timings_types.F ./core/dbcsr_timings_base_type.F ./core/dbcsr_dict.F ./core/dbcsr_log_handling.F ./core/dbcsr_array_types.F ./dbcsr_api.F ./base/dbcsr_base_hooks.F ./base/dbcsr_machine_internal.F ./base/dbcsr_kinds.F ./base/dbcsr_machine.F ./acc/dbcsr_acc_devmem.F ./acc/dbcsr_acc_stream.F ./acc/dbcsr_acc_hostmem.F ./acc/dbcsr_acc_event.F ./acc/dbcsr_acc_device.F ./acc/cuda/dbcsr_cuda_profiling.F ./acc/hip/dbcsr_hipblas.F ./acc/dbcsr_acc_init.F ./acc/dbcsr_acc_timings.F ./mpi/dbcsr_mp_operations.F ./mpi/dbcsr_mp_methods.F ./mpi/dbcsr_mpiwrap.F ./data/dbcsr_data_methods_low.F ./data/dbcsr_data_methods.F ./data/dbcsr_data_types.F ./data/dbcsr_mem_methods.F ./data/dbcsr_ptr_util.F ./data/dbcsr_data_operations.F ./tensors/dbcsr_array_list_methods.F ./tensors/dbcsr_tensor_block.F ./tensors/dbcsr_tensor_test.F ./tensors/dbcsr_tensor_index.F ./tensors/dbcsr_allocate_wrap.F ./tensors/dbcsr_tensor_split.F ./tensors/dbcsr_tensor.F ./tensors/dbcsr_tensor_api.F ./tensors/dbcsr_tensor_types.F ./tensors/dbcsr_tensor_reshape.F ./tensors/dbcsr_tensor_io.F ./ops/dbcsr_tests.F ./ops/dbcsr_operations.F ./ops/dbcsr_io.F ./ops/dbcsr_transformations.F ./ops/dbcsr_test_methods.F ./ops/dbcsr_csr_conversions.F ./acc/acc_bench_smm.c ./acc/acc_bench_trans.c .cp2k/Makefile:206: update target 'libdbcsr' due to: dirs makedep /usr/bin/make --no-print-directory -C /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr -f /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a INCLUDE_DEPS=true DBCSRHOME=/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_kinds.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_kinds.F python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_kinds.F dbcsr_kinds.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_kinds.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_kinds.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_kinds.mod' due to: dbcsr_kinds.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_kinds.F true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_machine_internal.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine_internal.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine_posix.f90 dbcsr_kinds.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine_internal.F dbcsr_machine_internal.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_machine_internal.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_machine_internal.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine_posix.f90:31:24: 31 | SUBROUTINE abort() BIND(C, name="abort") | 1 Warning: ‘abort’ declared at (1) may shadow the intrinsic of the same name. In order to call the intrinsic, explicit INTRINSIC declarations may be required. [-Wintrinsic-shadow] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine_posix.f90:60:8: 60 | FUNCTION kill(pid, sig) BIND(C, name="kill") RESULT(errno) | 1 Warning: ‘kill’ declared at (1) may shadow the intrinsic of the same name. In order to call the intrinsic, explicit INTRINSIC declarations may be required. [-Wintrinsic-shadow] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine_posix.f90:212:8: 212 | FUNCTION unlink(path) BIND(C, name="unlink") RESULT(errno) | 1 Warning: ‘unlink’ declared at (1) may shadow the intrinsic of the same name. In order to call the intrinsic, explicit INTRINSIC declarations may be required. [-Wintrinsic-shadow] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine_posix.f90:220:8: 220 | FUNCTION rename(src, dest) BIND(C, name="rename") RESULT(errno) | 1 Warning: ‘rename’ declared at (1) may shadow the intrinsic of the same name. In order to call the intrinsic, explicit INTRINSIC declarations may be required. [-Wintrinsic-shadow] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine_posix.f90:279:8: 279 | FUNCTION getcwd(buf, buflen) BIND(C, name="getcwd") RESULT(stat) | 1 Warning: ‘getcwd’ declared at (1) may shadow the intrinsic of the same name. In order to call the intrinsic, explicit INTRINSIC declarations may be required. [-Wintrinsic-shadow] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine_posix.f90:302:8: 302 | FUNCTION chdir(path) BIND(C, name="chdir") RESULT(errno) | 1 Warning: ‘chdir’ declared at (1) may shadow the intrinsic of the same name. In order to call the intrinsic, explicit INTRINSIC declarations may be required. [-Wintrinsic-shadow] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine_posix.f90:333:8: 333 | FUNCTION getuid() BIND(C, name="getuid") RESULT(uid) | 1 Warning: ‘getuid’ declared at (1) may shadow the intrinsic of the same name. In order to call the intrinsic, explicit INTRINSIC declarations may be required. [-Wintrinsic-shadow] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine_posix.f90:347:8: 347 | FUNCTION getpid() BIND(C, name="getpid") RESULT(pid) | 1 Warning: ‘getpid’ declared at (1) may shadow the intrinsic of the same name. In order to call the intrinsic, explicit INTRINSIC declarations may be required. [-Wintrinsic-shadow] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_machine_internal.mod' due to: dbcsr_machine_internal.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine_internal.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine_posix.f90 dbcsr_kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_machine.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine.F dbcsr_kinds.mod dbcsr_machine_internal.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine.F dbcsr_machine.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_machine.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_machine.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_machine.mod' due to: dbcsr_machine.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine.F dbcsr_kinds.mod dbcsr_machine_internal.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_base_hooks.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_hooks.F dbcsr_kinds.mod dbcsr_machine.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_hooks.F dbcsr_base_hooks.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_base_hooks.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_base_hooks.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_base_hooks.mod' due to: dbcsr_base_hooks.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_hooks.F dbcsr_kinds.mod dbcsr_machine.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_acc_stream.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_stream.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_stream.F dbcsr_acc_stream.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_acc_stream.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_acc_stream.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_acc_stream.mod' due to: dbcsr_acc_stream.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_stream.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_acc_event.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_event.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_acc_stream.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_event.F dbcsr_acc_event.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_acc_event.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_acc_event.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_acc_event.mod' due to: dbcsr_acc_event.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_event.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_acc_stream.mod dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_acc_devmem.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_devmem.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_acc_stream.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_devmem.F dbcsr_acc_devmem.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_acc_devmem.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_acc_devmem.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_acc_devmem.mod' due to: dbcsr_acc_devmem.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_devmem.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_acc_stream.mod dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_data_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_types.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_acc_event.mod dbcsr_kinds.mod dbcsr_acc_devmem.mod dbcsr_base_hooks.mod dbcsr_acc_stream.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_types.F dbcsr_data_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_data_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_data_types.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_data_types.mod' due to: dbcsr_data_types.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_types.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_acc_event.mod dbcsr_kinds.mod dbcsr_acc_devmem.mod dbcsr_base_hooks.mod dbcsr_acc_stream.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_array_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_array_types.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_array_types.F dbcsr_array_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_array_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_array_types.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_array_types.mod' due to: dbcsr_array_types.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_array_types.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_btree.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_btree.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_btree.fypp python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_btree.F dbcsr_btree.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_btree.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_btree.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_btree.mod' due to: dbcsr_btree.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_btree.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_btree.fypp true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_types.F dbcsr_data_types.mod dbcsr_array_types.mod dbcsr_kinds.mod dbcsr_btree.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_types.F dbcsr_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_types.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_types.mod' due to: dbcsr_types.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_types.F dbcsr_data_types.mod dbcsr_array_types.mod dbcsr_kinds.mod dbcsr_btree.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mpiwrap.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mpiwrap.fypp dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_machine.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F dbcsr_mpiwrap.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mpiwrap.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mpi/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_mpiwrap.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mpiwrap.mod' due to: dbcsr_mpiwrap.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mpiwrap.fypp dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_machine.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_array_sort.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_array_sort.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_array_sort.fypp dbcsr_kinds.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_array_sort.F dbcsr_array_sort.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_array_sort.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_array_sort.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_array_sort.mod' due to: dbcsr_array_sort.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_array_sort.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_array_sort.fypp dbcsr_kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_toollib.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_toollib.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_array_sort.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_toollib.F dbcsr_toollib.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_toollib.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_toollib.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_toollib.mod' due to: dbcsr_toollib.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_toollib.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_array_sort.mod dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_acc_hostmem.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_hostmem.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_acc_stream.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_hostmem.F dbcsr_acc_hostmem.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_acc_hostmem.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_acc_hostmem.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_acc_hostmem.mod' due to: dbcsr_acc_hostmem.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_hostmem.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_acc_stream.mod dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_ptr_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr_ptr_util.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_data_types.mod dbcsr_acc_hostmem.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr_ptr_util.F dbcsr_ptr_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_ptr_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_ptr_util.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_ptr_util.mod' due to: dbcsr_ptr_util.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr_ptr_util.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_data_types.mod dbcsr_acc_hostmem.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_data_methods_low.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_methods_low.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_data_types.mod dbcsr_ptr_util.mod dbcsr_acc_event.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_acc_devmem.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_methods_low.F dbcsr_data_methods_low.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_data_methods_low.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_data_methods_low.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_data_methods_low.mod' due to: dbcsr_data_methods_low.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_methods_low.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_data_types.mod dbcsr_ptr_util.mod dbcsr_acc_event.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_acc_devmem.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mem_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr_mem_methods.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_data_methods_low.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_acc_stream.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr_mem_methods.F dbcsr_mem_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mem_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_mem_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mem_methods.mod' due to: dbcsr_mem_methods.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr_mem_methods.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_data_methods_low.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_acc_stream.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_data_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_methods.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_data_methods_low.mod dbcsr_mem_methods.mod dbcsr_ptr_util.mod dbcsr_acc_event.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_acc_devmem.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_methods.F dbcsr_data_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_data_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_data_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_data_methods.mod' due to: dbcsr_data_methods.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_methods.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_data_methods_low.mod dbcsr_mem_methods.mod dbcsr_ptr_util.mod dbcsr_acc_event.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_acc_devmem.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_methods.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_btree.mod dbcsr_ptr_util.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_methods.F dbcsr_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_methods.mod' due to: dbcsr_methods.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_methods.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_btree.mod dbcsr_ptr_util.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mp_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mp_methods.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_mpiwrap.mod dbcsr_methods.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mp_methods.F dbcsr_mp_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mp_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mpi/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_mp_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mp_methods.mod' due to: dbcsr_mp_methods.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mp_methods.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_mpiwrap.mod dbcsr_methods.mod dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_min_heap.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_min_heap.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_min_heap.F dbcsr_min_heap.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_min_heap.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_min_heap.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_min_heap.mod' due to: dbcsr_min_heap.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_min_heap.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_acc_device.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_device.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_device.F dbcsr_acc_device.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_acc_device.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_acc_device.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_acc_device.mod' due to: dbcsr_acc_device.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_device.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_config.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_config.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_acc_device.mod dbcsr_ptr_util.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_config.F dbcsr_config.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_config.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_config.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_config.mod' due to: dbcsr_config.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_config.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_acc_device.mod dbcsr_ptr_util.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_dist_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_methods.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_min_heap.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_mp_methods.mod dbcsr_base_hooks.mod dbcsr_methods.mod dbcsr_config.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_methods.F dbcsr_dist_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_dist_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/dist/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_dist_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_dist_methods.mod' due to: dbcsr_dist_methods.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_methods.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_min_heap.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_mp_methods.mod dbcsr_base_hooks.mod dbcsr_methods.mod dbcsr_config.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_dist_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_util.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_mp_methods.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_methods.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_util.F dbcsr_dist_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_dist_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/dist/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_dist_util.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_dist_util.mod' due to: dbcsr_dist_util.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_util.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_mp_methods.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_dist_operations.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_min_heap.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_mp_methods.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_operations.F dbcsr_dist_operations.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_dist_operations.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/dist/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_dist_operations.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_dist_operations.mod' due to: dbcsr_dist_operations.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_min_heap.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_mp_methods.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_index_operations.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/block/dbcsr_index_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_ptr_util.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_base_hooks.mod dbcsr_dist_operations.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_config.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/block/dbcsr_index_operations.F dbcsr_index_operations.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_index_operations.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/block/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_index_operations.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_index_operations.mod' due to: dbcsr_index_operations.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/block/dbcsr_index_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_ptr_util.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_base_hooks.mod dbcsr_dist_operations.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_config.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_string_utilities.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_string_utilities.F dbcsr_kinds.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_string_utilities.F dbcsr_string_utilities.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_string_utilities.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_string_utilities.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_string_utilities.mod' due to: dbcsr_string_utilities.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_string_utilities.F dbcsr_kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_block_operations.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/block/dbcsr_block_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_data_methods_low.mod dbcsr_ptr_util.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_acc_devmem.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/block/dbcsr_block_operations.F dbcsr_block_operations.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_block_operations.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/block/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_block_operations.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/block/dbcsr_block_operations.F:939:61: 939 | dst_sizes(1), dst_sizes(2)) | ^ Warning: ‘src_ub[1]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_block_operations.mod' due to: dbcsr_block_operations.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/block/dbcsr_block_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_data_methods_low.mod dbcsr_ptr_util.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_acc_devmem.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_data_operations.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_dist_util.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_block_operations.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_operations.F dbcsr_data_operations.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_data_operations.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_data_operations.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_data_operations.mod' due to: dbcsr_data_operations.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_dist_util.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_block_operations.mod dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_iterator_operations.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/block/dbcsr_iterator_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_array_types.mod dbcsr_ptr_util.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_methods.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/block/dbcsr_iterator_operations.F dbcsr_iterator_operations.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_iterator_operations.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/block/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_iterator_operations.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_iterator_operations.mod' due to: dbcsr_iterator_operations.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/block/dbcsr_iterator_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_array_types.mod dbcsr_ptr_util.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_work_operations.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/work/dbcsr_work_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_array_types.mod dbcsr_dist_util.mod dbcsr_btree.mod dbcsr_mem_methods.mod dbcsr_index_operations.mod dbcsr_ptr_util.mod dbcsr_string_utilities.mod dbcsr_data_operations.mod dbcsr_data_methods.mod dbcsr_toollib.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_iterator_operations.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_config.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/work/dbcsr_work_operations.F dbcsr_work_operations.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_work_operations.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/work/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_work_operations.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mp_operations.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mp_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_ptr_util.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_mp_methods.mod dbcsr_base_hooks.mod dbcsr_config.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mp_operations.F dbcsr_mp_operations.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mp_operations.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mpi/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_mp_operations.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_acc_init.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_init.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_init.F dbcsr_acc_init.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_acc_init.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_acc_init.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_acc_timings.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_timings.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_timings.F dbcsr_acc_timings.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_acc_timings.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_acc_timings.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_cuda_profiling.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/cuda/dbcsr_cuda_profiling.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/cuda/dbcsr_cuda_profiling.F dbcsr_cuda_profiling.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_cuda_profiling.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/cuda/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_cuda_profiling.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_hipblas.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/hip/dbcsr_hipblas.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/hip/dbcsr_hipblas.F dbcsr_hipblas.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_hipblas.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/hip/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_hipblas.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_iter_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_iter_types.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_iter_types.F dbcsr_iter_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_iter_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_iter_types.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_types.F python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_types.F dbcsr_mm_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_types.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_types.mod' due to: dbcsr_mm_types.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_types.F true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_hostdrv.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_hostdrv.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_mm_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_config.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_hostdrv.F dbcsr_mm_hostdrv.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_hostdrv.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_hostdrv.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_hostdrv.mod' due to: dbcsr_mm_hostdrv.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_hostdrv.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_mm_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_config.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_acc_operations.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_acc_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_mm_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_acc_devmem.mod dbcsr_acc_stream.mod dbcsr_config.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_acc_operations.F dbcsr_acc_operations.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_acc_operations.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_acc_operations.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_acc_operations.mod' due to: dbcsr_acc_operations.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_acc_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_mm_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_acc_devmem.mod dbcsr_acc_stream.mod dbcsr_config.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_accdrv.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_accdrv.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_mm_types.mod dbcsr_types.mod dbcsr_acc_hostmem.mod dbcsr_mem_methods.mod dbcsr_acc_operations.mod dbcsr_acc_event.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_block_operations.mod dbcsr_acc_devmem.mod dbcsr_acc_stream.mod dbcsr_config.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_accdrv.F dbcsr_mm_accdrv.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_accdrv.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_accdrv.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_accdrv.mod' due to: dbcsr_mm_accdrv.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_accdrv.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_mm_types.mod dbcsr_types.mod dbcsr_acc_hostmem.mod dbcsr_mem_methods.mod dbcsr_acc_operations.mod dbcsr_acc_event.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_block_operations.mod dbcsr_acc_devmem.mod dbcsr_acc_stream.mod dbcsr_config.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_sched.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_sched.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_mm_types.mod dbcsr_types.mod dbcsr_mm_hostdrv.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_mm_accdrv.mod dbcsr_block_operations.mod dbcsr_base_hooks.mod dbcsr_config.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_sched.F dbcsr_mm_sched.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_sched.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_sched.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_sched.mod' due to: dbcsr_mm_sched.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_sched.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_mm_types.mod dbcsr_types.mod dbcsr_mm_hostdrv.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_mm_accdrv.mod dbcsr_block_operations.mod dbcsr_base_hooks.mod dbcsr_config.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mp_operations.mod' due to: dbcsr_mp_operations.o true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_work_operations.mod' due to: dbcsr_work_operations.o true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_csr.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_csr.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_hash_table.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_hash_table_types.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_mm_types.mod dbcsr_types.mod dbcsr_array_types.mod dbcsr_dist_util.mod dbcsr_ptr_util.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_block_operations.mod dbcsr_base_hooks.mod dbcsr_mm_sched.mod dbcsr_config.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_csr.F dbcsr_mm_csr.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_csr.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_csr.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_csr.mod' due to: dbcsr_mm_csr.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_csr.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_hash_table.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_hash_table_types.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_mm_types.mod dbcsr_types.mod dbcsr_array_types.mod dbcsr_dist_util.mod dbcsr_ptr_util.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_block_operations.mod dbcsr_base_hooks.mod dbcsr_mm_sched.mod dbcsr_config.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_multrec.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_multrec.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_array_types.mod dbcsr_mm_csr.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_config.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_multrec.F dbcsr_mm_multrec.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_multrec.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_multrec.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_multrec.mod' due to: dbcsr_mm_multrec.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_multrec.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_array_types.mod dbcsr_mm_csr.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_config.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_common.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_common.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_array_types.mod dbcsr_mm_multrec.mod dbcsr_acc_operations.mod dbcsr_acc_event.mod dbcsr_ptr_util.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_work_operations.mod dbcsr_acc_stream.mod dbcsr_base_hooks.mod dbcsr_methods.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_common.F dbcsr_mm_common.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_common.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_common.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_common.mod' due to: dbcsr_mm_common.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_common.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_array_types.mod dbcsr_mm_multrec.mod dbcsr_acc_operations.mod dbcsr_acc_event.mod dbcsr_ptr_util.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_work_operations.mod dbcsr_acc_stream.mod dbcsr_base_hooks.mod dbcsr_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_dist_operations.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_dist_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_toollib.mod dbcsr_base_hooks.mod dbcsr_mp_methods.mod dbcsr_dist_operations.mod dbcsr_dist_methods.mod dbcsr_methods.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_dist_operations.F dbcsr_mm_dist_operations.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_dist_operations.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_dist_operations.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_dist_operations.mod' due to: dbcsr_mm_dist_operations.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_dist_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_toollib.mod dbcsr_base_hooks.mod dbcsr_mp_methods.mod dbcsr_dist_operations.mod dbcsr_dist_methods.mod dbcsr_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_3d.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_3d.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_array_types.mod dbcsr_data_types.mod dbcsr_types.mod dbcsr_ptr_util.mod dbcsr_acc_event.mod dbcsr_index_operations.mod dbcsr_mem_methods.mod dbcsr_mp_operations.mod dbcsr_work_operations.mod dbcsr_machine.mod dbcsr_dist_util.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_mm_common.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_config.mod dbcsr_mm_multrec.mod dbcsr_mpiwrap.mod dbcsr_block_operations.mod dbcsr_iterator_operations.mod dbcsr_mp_methods.mod dbcsr_mm_dist_operations.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_3d.F dbcsr_mm_3d.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_3d.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_3d.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_3d.F:1890:60: 1890 | left_buffer_p => left_buffers(ileft_buffer_calc) | ^ Warning: ‘ileft_buffer_calc’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_3d.F:1889:63: 1889 | right_buffer_p => right_buffers(iright_buffer_calc) | ^ Warning: ‘iright_buffer_calc’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_3d.mod' due to: dbcsr_mm_3d.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_3d.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_array_types.mod dbcsr_data_types.mod dbcsr_types.mod dbcsr_ptr_util.mod dbcsr_acc_event.mod dbcsr_index_operations.mod dbcsr_mem_methods.mod dbcsr_mp_operations.mod dbcsr_work_operations.mod dbcsr_machine.mod dbcsr_dist_util.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_mm_common.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_config.mod dbcsr_mm_multrec.mod dbcsr_mpiwrap.mod dbcsr_block_operations.mod dbcsr_iterator_operations.mod dbcsr_mp_methods.mod dbcsr_mm_dist_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_acc_init.mod' due to: dbcsr_acc_init.o true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_block_access.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/block/dbcsr_block_access.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_array_types.mod dbcsr_btree.mod dbcsr_index_operations.mod dbcsr_ptr_util.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_block_operations.mod dbcsr_mp_methods.mod dbcsr_work_operations.mod dbcsr_dist_operations.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_config.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/block/dbcsr_block_access.F dbcsr_block_access.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_block_access.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/block/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_block_access.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_block_access.mod' due to: dbcsr_block_access.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/block/dbcsr_block_access.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_array_types.mod dbcsr_btree.mod dbcsr_index_operations.mod dbcsr_ptr_util.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_block_operations.mod dbcsr_mp_methods.mod dbcsr_work_operations.mod dbcsr_dist_operations.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_config.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_blas_operations.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_blas_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_kinds.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_blas_operations.F dbcsr_blas_operations.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_blas_operations.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_blas_operations.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_blas_operations.mod' due to: dbcsr_blas_operations.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_blas_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_kinds.mod dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_operations.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_array_types.mod dbcsr_types.mod dbcsr_ptr_util.mod dbcsr_index_operations.mod dbcsr_work_operations.mod dbcsr_dist_operations.mod dbcsr_dist_util.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_blas_operations.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_block_access.mod dbcsr_config.mod dbcsr_mpiwrap.mod dbcsr_data_operations.mod dbcsr_block_operations.mod dbcsr_iterator_operations.mod dbcsr_mp_methods.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_operations.F dbcsr_operations.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_operations.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_operations.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_operations.mod' due to: dbcsr_operations.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_operations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_array_types.mod dbcsr_types.mod dbcsr_ptr_util.mod dbcsr_index_operations.mod dbcsr_work_operations.mod dbcsr_dist_operations.mod dbcsr_dist_util.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_blas_operations.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_block_access.mod dbcsr_config.mod dbcsr_mpiwrap.mod dbcsr_data_operations.mod dbcsr_block_operations.mod dbcsr_iterator_operations.mod dbcsr_mp_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_transformations.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_transformations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_array_types.mod dbcsr_types.mod dbcsr_ptr_util.mod dbcsr_index_operations.mod dbcsr_mp_operations.mod dbcsr_work_operations.mod dbcsr_dist_operations.mod dbcsr_dist_util.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_block_access.mod dbcsr_mpiwrap.mod dbcsr_data_operations.mod dbcsr_block_operations.mod dbcsr_iterator_operations.mod dbcsr_mp_methods.mod dbcsr_operations.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_transformations.F dbcsr_transformations.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_transformations.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_transformations.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_transformations.mod' due to: dbcsr_transformations.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_transformations.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_array_types.mod dbcsr_types.mod dbcsr_ptr_util.mod dbcsr_index_operations.mod dbcsr_mp_operations.mod dbcsr_work_operations.mod dbcsr_dist_operations.mod dbcsr_dist_util.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_block_access.mod dbcsr_mpiwrap.mod dbcsr_data_operations.mod dbcsr_block_operations.mod dbcsr_iterator_operations.mod dbcsr_mp_methods.mod dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_io.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_io.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_transformations.mod dbcsr_kinds.mod dbcsr_mp_operations.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_mp_methods.mod dbcsr_work_operations.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_machine.mod dbcsr_methods.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_io.F dbcsr_io.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_io.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_io.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_io.mod' due to: dbcsr_io.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_io.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_transformations.mod dbcsr_kinds.mod dbcsr_mp_operations.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_mp_methods.mod dbcsr_work_operations.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_machine.mod dbcsr_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_cannon.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_cannon.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_array_types.mod dbcsr_data_types.mod dbcsr_types.mod dbcsr_ptr_util.mod dbcsr_acc_event.mod dbcsr_index_operations.mod dbcsr_mem_methods.mod dbcsr_mp_operations.mod dbcsr_work_operations.mod dbcsr_machine.mod dbcsr_transformations.mod dbcsr_dist_util.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_mm_common.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_config.mod dbcsr_mm_multrec.mod dbcsr_mpiwrap.mod dbcsr_io.mod dbcsr_block_operations.mod dbcsr_iterator_operations.mod dbcsr_mp_methods.mod dbcsr_operations.mod dbcsr_mm_dist_operations.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_cannon.F dbcsr_mm_cannon.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_cannon.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_cannon.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_cannon.mod' due to: dbcsr_mm_cannon.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_cannon.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_array_types.mod dbcsr_data_types.mod dbcsr_types.mod dbcsr_ptr_util.mod dbcsr_acc_event.mod dbcsr_index_operations.mod dbcsr_mem_methods.mod dbcsr_mp_operations.mod dbcsr_work_operations.mod dbcsr_machine.mod dbcsr_transformations.mod dbcsr_dist_util.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_mm_common.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_config.mod dbcsr_mm_multrec.mod dbcsr_mpiwrap.mod dbcsr_io.mod dbcsr_block_operations.mod dbcsr_iterator_operations.mod dbcsr_mp_methods.mod dbcsr_operations.mod dbcsr_mm_dist_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_array_types.mod dbcsr_types.mod dbcsr_mm_sched.mod dbcsr_index_operations.mod dbcsr_acc_device.mod dbcsr_mm_3d.mod dbcsr_acc_init.mod dbcsr_mem_methods.mod dbcsr_mm_cannon.mod dbcsr_work_operations.mod dbcsr_machine.mod dbcsr_acc_stream.mod dbcsr_transformations.mod dbcsr_dist_util.mod dbcsr_string_utilities.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_mm_common.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_config.mod dbcsr_mm_multrec.mod dbcsr_mpiwrap.mod dbcsr_io.mod dbcsr_mp_methods.mod dbcsr_operations.mod dbcsr_mm_dist_operations.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm.F dbcsr_mm.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_mm.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm.mod' due to: dbcsr_mm.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_array_types.mod dbcsr_types.mod dbcsr_mm_sched.mod dbcsr_index_operations.mod dbcsr_acc_device.mod dbcsr_mm_3d.mod dbcsr_acc_init.mod dbcsr_mem_methods.mod dbcsr_mm_cannon.mod dbcsr_work_operations.mod dbcsr_machine.mod dbcsr_acc_stream.mod dbcsr_transformations.mod dbcsr_dist_util.mod dbcsr_string_utilities.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_mm_common.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_config.mod dbcsr_mm_multrec.mod dbcsr_mpiwrap.mod dbcsr_io.mod dbcsr_mp_methods.mod dbcsr_operations.mod dbcsr_mm_dist_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_print_messages.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_print_messages.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_print_messages.F dbcsr_print_messages.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_print_messages.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_print_messages.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_print_messages.mod' due to: dbcsr_print_messages.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_print_messages.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_timings_base_type.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings_base_type.F dbcsr_kinds.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings_base_type.F dbcsr_timings_base_type.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_timings_base_type.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_timings_base_type.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_timings_base_type.mod' due to: dbcsr_timings_base_type.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings_base_type.F dbcsr_kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_list_routinestat.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_routinestat.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp dbcsr_timings_base_type.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_routinestat.F dbcsr_list_routinestat.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_list_routinestat.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_list_routinestat.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_list_routinestat.mod' due to: dbcsr_list_routinestat.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_routinestat.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp dbcsr_timings_base_type.mod dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_list_callstackentry.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_callstackentry.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp dbcsr_timings_base_type.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_callstackentry.F dbcsr_list_callstackentry.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_list_callstackentry.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_list_callstackentry.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_list_callstackentry.mod' due to: dbcsr_list_callstackentry.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_callstackentry.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp dbcsr_timings_base_type.mod dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_dict.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_dict.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_dict.fypp dbcsr_timings_base_type.mod dbcsr_kinds.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_dict.F dbcsr_dict.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_dict.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_dict.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_dict.mod' due to: dbcsr_dict.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_dict.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_dict.fypp dbcsr_timings_base_type.mod dbcsr_kinds.mod dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_timings_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings_types.F dbcsr_list_routinestat.mod dbcsr_list_callstackentry.mod dbcsr_dict.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings_types.F dbcsr_timings_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_timings_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_timings_types.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_timings_types.mod' due to: dbcsr_timings_types.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings_types.F dbcsr_list_routinestat.mod dbcsr_list_callstackentry.mod dbcsr_dict.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_list_timerenv.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_timerenv.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp dbcsr_timings_types.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_timerenv.F dbcsr_list_timerenv.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_list_timerenv.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_list_timerenv.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_list_timerenv.mod' due to: dbcsr_list_timerenv.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_timerenv.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp dbcsr_timings_types.mod dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_list_routinereport.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_routinereport.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp dbcsr_timings_base_type.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_routinereport.F dbcsr_list_routinereport.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_list_routinereport.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_list_routinereport.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_list_routinereport.mod' due to: dbcsr_list_routinereport.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_routinereport.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp dbcsr_timings_base_type.mod dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_list.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp dbcsr_timings_base_type.mod dbcsr_list_routinestat.mod dbcsr_list_timerenv.mod dbcsr_base_hooks.mod dbcsr_list_routinereport.mod dbcsr_list_callstackentry.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.F dbcsr_list.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_list.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_list.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_list.mod' due to: dbcsr_list.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp dbcsr_timings_base_type.mod dbcsr_list_routinestat.mod dbcsr_list_timerenv.mod dbcsr_base_hooks.mod dbcsr_list_routinereport.mod dbcsr_list_callstackentry.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_cuda_profiling.mod' due to: dbcsr_cuda_profiling.o true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_timings.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_timings_base_type.mod dbcsr_timings_types.mod dbcsr_list.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_cuda_profiling.mod dbcsr_acc_devmem.mod dbcsr_machine.mod dbcsr_dict.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings.F dbcsr_timings.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_timings.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_timings.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_timings.mod' due to: dbcsr_timings.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_timings_base_type.mod dbcsr_timings_types.mod dbcsr_list.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_cuda_profiling.mod dbcsr_acc_devmem.mod dbcsr_machine.mod dbcsr_dict.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_iter_types.mod' due to: dbcsr_iter_types.o true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_files.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_files.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_machine.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_files.F dbcsr_files.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_files.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_files.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_files.mod' due to: dbcsr_files.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_files.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_machine.mod dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_log_handling.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_log_handling.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_iter_types.mod dbcsr_string_utilities.mod dbcsr_timings.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_machine.mod dbcsr_methods.mod dbcsr_files.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_log_handling.F dbcsr_log_handling.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_log_handling.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_log_handling.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_log_handling.mod' due to: dbcsr_log_handling.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_log_handling.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_iter_types.mod dbcsr_string_utilities.mod dbcsr_timings.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_machine.mod dbcsr_methods.mod dbcsr_files.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_error_handling.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_error_handling.F dbcsr_print_messages.mod dbcsr_timings.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_log_handling.mod dbcsr_base_hooks.mod dbcsr_machine.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_error_handling.F dbcsr_error_handling.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_error_handling.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_error_handling.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_error_handling.mod' due to: dbcsr_error_handling.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_error_handling.F dbcsr_print_messages.mod dbcsr_timings.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_log_handling.mod dbcsr_base_hooks.mod dbcsr_machine.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_timings_report.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings_report.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_timings_base_type.mod dbcsr_timings_types.mod dbcsr_types.mod dbcsr_list.mod dbcsr_timings.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_toollib.mod dbcsr_base_hooks.mod dbcsr_list_routinereport.mod dbcsr_files.mod dbcsr_dict.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings_report.F dbcsr_timings_report.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_timings_report.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_timings_report.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_timings_report.mod' due to: dbcsr_timings_report.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings_report.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_timings_base_type.mod dbcsr_timings_types.mod dbcsr_types.mod dbcsr_list.mod dbcsr_timings.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_toollib.mod dbcsr_base_hooks.mod dbcsr_list_routinereport.mod dbcsr_files.mod dbcsr_dict.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_lib.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_lib.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_mm.mod dbcsr_acc_device.mod dbcsr_error_handling.mod dbcsr_timings.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_mp_methods.mod dbcsr_timings_report.mod dbcsr_log_handling.mod dbcsr_base_hooks.mod dbcsr_machine.mod dbcsr_config.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_lib.F dbcsr_lib.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_lib.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_lib.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_multiply_api.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_multiply_api.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_mm.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_methods.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_multiply_api.F dbcsr_multiply_api.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_multiply_api.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_multiply_api.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_test_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_test_methods.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_dist_util.mod dbcsr_ptr_util.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_blas_operations.mod dbcsr_block_operations.mod dbcsr_iterator_operations.mod dbcsr_mp_methods.mod dbcsr_work_operations.mod dbcsr_base_hooks.mod dbcsr_dist_operations.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_block_access.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_test_methods.F dbcsr_test_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_test_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_test_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_test_methods.mod' due to: dbcsr_test_methods.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_test_methods.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_dist_util.mod dbcsr_ptr_util.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_blas_operations.mod dbcsr_block_operations.mod dbcsr_iterator_operations.mod dbcsr_mp_methods.mod dbcsr_work_operations.mod dbcsr_base_hooks.mod dbcsr_dist_operations.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_block_access.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_multiply_api.mod' due to: dbcsr_multiply_api.o true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tests.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_tests.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_transformations.mod dbcsr_dist_util.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_io.mod dbcsr_test_methods.mod dbcsr_multiply_api.mod dbcsr_base_hooks.mod dbcsr_mp_methods.mod dbcsr_work_operations.mod dbcsr_operations.mod dbcsr_dist_operations.mod dbcsr_dist_methods.mod dbcsr_machine.mod dbcsr_methods.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_tests.F dbcsr_tests.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tests.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_tests.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_csr_conversions.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_csr_conversions.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_types.mod dbcsr_transformations.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_iterator_operations.mod dbcsr_mp_methods.mod dbcsr_work_operations.mod dbcsr_operations.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_block_access.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_csr_conversions.F dbcsr_csr_conversions.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_csr_conversions.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_csr_conversions.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_csr_conversions.F:862:49: 862 | csr_mat%dbcsr_mapping%dbcsr_row_blk_size = dbcsr_row_block_sizes(dbcsr_mat_nosym) | 1 Warning: POINTER-valued function appears on right-hand side of assignment at (1) [-Wsurprising] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_csr_conversions.F:863:49: 863 | csr_mat%dbcsr_mapping%dbcsr_col_blk_size = dbcsr_col_block_sizes(dbcsr_mat_nosym) | 1 Warning: POINTER-valued function appears on right-hand side of assignment at (1) [-Wsurprising] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_global.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_global.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_global.F dbcsr_tas_global.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tas_global.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_tas_global.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_global.mod' due to: dbcsr_tas_global.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_global.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_types.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_tas_global.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_types.F dbcsr_tas_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tas_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_tas_types.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_types.mod' due to: dbcsr_tas_types.o true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_util.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_mp_methods.mod dbcsr_base_hooks.mod dbcsr_index_operations.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_util.F dbcsr_tas_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tas_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_tas_util.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_util.mod' due to: dbcsr_tas_util.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_util.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_mp_methods.mod dbcsr_base_hooks.mod dbcsr_index_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_split.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_split.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tas_types.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_toollib.mod dbcsr_base_hooks.mod dbcsr_tas_util.mod dbcsr_tas_global.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_split.F dbcsr_tas_split.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tas_split.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_tas_split.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_split.F:531:44: 531 | iproc = pcoord(1)*pdims(2) + pcoord(2) | ^ Warning: ‘pcoord[1]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_split.F:531:44: Warning: ‘pcoord[0]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_split.F:496:94: 496 | IF (PRESENT(iproc_group)) iproc_group = pcoord_group(1)*pdims_group(2) + pcoord_group(2) | ^ Warning: ‘pcoord_group[1]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_split.F:496:94: Warning: ‘pcoord_group[0]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_split.mod' due to: dbcsr_tas_split.o true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_base.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_base.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas.fypp dbcsr_data_types.mod dbcsr_types.mod dbcsr_tas_types.mod dbcsr_data_methods_low.mod dbcsr_tas_split.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_iterator_operations.mod dbcsr_work_operations.mod dbcsr_operations.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_tas_util.mod dbcsr_tas_global.mod dbcsr_methods.mod dbcsr_block_access.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_base.F dbcsr_tas_base.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tas_base.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_tas_base.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_base.mod' due to: dbcsr_tas_base.o true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_reshape_ops.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_reshape_ops.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas.fypp dbcsr_tas_types.mod dbcsr_data_types.mod dbcsr_types.mod dbcsr_tas_split.mod dbcsr_tas_util.mod dbcsr_tas_global.mod dbcsr_work_operations.mod dbcsr_dist_operations.mod dbcsr_data_methods_low.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_block_access.mod dbcsr_tas_base.mod dbcsr_mpiwrap.mod dbcsr_iterator_operations.mod dbcsr_operations.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_reshape_ops.F dbcsr_tas_reshape_ops.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tas_reshape_ops.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_tas_reshape_ops.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_reshape_ops.mod' due to: dbcsr_tas_reshape_ops.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_reshape_ops.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas.fypp dbcsr_tas_types.mod dbcsr_data_types.mod dbcsr_types.mod dbcsr_tas_split.mod dbcsr_tas_util.mod dbcsr_tas_global.mod dbcsr_work_operations.mod dbcsr_dist_operations.mod dbcsr_data_methods_low.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_block_access.mod dbcsr_tas_base.mod dbcsr_mpiwrap.mod dbcsr_iterator_operations.mod dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_io.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_io.F dbcsr_tas_types.mod dbcsr_tas_split.mod dbcsr_tas_base.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_dist_methods.mod dbcsr_tas_global.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_io.F dbcsr_tas_io.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tas_io.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_tas_io.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_io.mod' due to: dbcsr_tas_io.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_io.F dbcsr_tas_types.mod dbcsr_tas_split.mod dbcsr_tas_base.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_dist_methods.mod dbcsr_tas_global.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_mm.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_mm.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas.fypp dbcsr_tas_types.mod dbcsr_data_types.mod dbcsr_types.mod dbcsr_tas_split.mod dbcsr_tas_util.mod dbcsr_tas_global.mod dbcsr_multiply_api.mod dbcsr_work_operations.mod dbcsr_transformations.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_config.mod dbcsr_tas_base.mod dbcsr_mpiwrap.mod dbcsr_operations.mod dbcsr_tas_reshape_ops.mod dbcsr_tas_io.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_mm.F dbcsr_tas_mm.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tas_mm.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_tas_mm.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_mm.F:1457:128: 1457 | nsplit = INT(MIN(INT(numnodes, KIND=int_8), NINT(REAL(max_nze, real_8)/(REAL(min_nze, real_8)*s_opt_factor), KIND=int_8))) | ^ Warning: ‘min_nze’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_mm.F:1457:128: Warning: ‘max_nze’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_mm.F:1027:48: 1027 | nsplit_prv = INT((d1 - 1)/d2 + 1) | ^ Warning: ‘d2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_mm.F:1027:48: Warning: ‘d1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_mm.F:653:37: 653 | DEALLOCATE (matrix_a_rep) | ^ Warning: ‘matrix_a_rep’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_mm.F:612:37: 612 | DEALLOCATE (matrix_c_rep) | ^ Warning: ‘matrix_c_rep’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_mm.F:482:37: 482 | DEALLOCATE (matrix_b_rep) | ^ Warning: ‘matrix_b_rep’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_mm.mod' due to: dbcsr_tas_mm.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_mm.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas.fypp dbcsr_tas_types.mod dbcsr_data_types.mod dbcsr_types.mod dbcsr_tas_split.mod dbcsr_tas_util.mod dbcsr_tas_global.mod dbcsr_multiply_api.mod dbcsr_work_operations.mod dbcsr_transformations.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_config.mod dbcsr_tas_base.mod dbcsr_mpiwrap.mod dbcsr_operations.mod dbcsr_tas_reshape_ops.mod dbcsr_tas_io.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_test.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_test.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tas_types.mod dbcsr_types.mod dbcsr_tas_split.mod dbcsr_tas_util.mod dbcsr_tas_global.mod dbcsr_multiply_api.mod dbcsr_work_operations.mod dbcsr_transformations.mod dbcsr_dist_util.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_blas_operations.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_tas_mm.mod dbcsr_methods.mod dbcsr_tas_base.mod dbcsr_mpiwrap.mod dbcsr_operations.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_test.F dbcsr_tas_test.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tas_test.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tas/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_tas_test.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tests.mod' due to: dbcsr_tests.o true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_lib.mod' due to: dbcsr_lib.o true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_csr_conversions.mod' due to: dbcsr_csr_conversions.o true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_api.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/dbcsr_api.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_array_types.mod dbcsr_types.mod dbcsr_tests.mod dbcsr_test_methods.mod dbcsr_multiply_api.mod dbcsr_work_operations.mod dbcsr_lib.mod dbcsr_dist_operations.mod dbcsr_csr_conversions.mod dbcsr_transformations.mod dbcsr_dist_util.mod dbcsr_string_utilities.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_block_access.mod dbcsr_config.mod dbcsr_mpiwrap.mod dbcsr_io.mod dbcsr_iterator_operations.mod dbcsr_mp_methods.mod dbcsr_operations.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/dbcsr_api.F dbcsr_api.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_api.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_api.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_allocate_wrap.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_allocate_wrap.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_allocate_wrap.F dbcsr_allocate_wrap.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_allocate_wrap.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_allocate_wrap.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_allocate_wrap.mod' due to: dbcsr_allocate_wrap.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_allocate_wrap.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor_index.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_index.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_allocate_wrap.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_index.F dbcsr_tensor_index.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tensor_index.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_tensor_index.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tensor_index.mod' due to: dbcsr_tensor_index.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_index.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_allocate_wrap.mod dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_array_list_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_array_list_methods.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tensor_index.mod dbcsr_allocate_wrap.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_array_list_methods.F dbcsr_array_list_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_array_list_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_array_list_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_api.mod' due to: dbcsr_api.o true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_array_list_methods.mod' due to: dbcsr_array_list_methods.o true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_types.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_tas_types.mod dbcsr_tas_split.mod dbcsr_tensor_index.mod dbcsr_allocate_wrap.mod dbcsr_tas_base.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_toollib.mod dbcsr_operations.mod dbcsr_api.mod dbcsr_base_hooks.mod dbcsr_tas_mm.mod dbcsr_tas_global.mod dbcsr_array_list_methods.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_types.F dbcsr_tensor_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tensor_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_tensor_types.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tensor_types.mod' due to: dbcsr_tensor_types.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_types.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_tas_types.mod dbcsr_tas_split.mod dbcsr_tensor_index.mod dbcsr_allocate_wrap.mod dbcsr_tas_base.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_toollib.mod dbcsr_operations.mod dbcsr_api.mod dbcsr_base_hooks.mod dbcsr_tas_mm.mod dbcsr_tas_global.mod dbcsr_array_list_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor_block.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_block.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tensor_types.mod dbcsr_tas_types.mod dbcsr_tensor_index.mod dbcsr_allocate_wrap.mod dbcsr_tas_base.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_base_hooks.mod dbcsr_api.mod dbcsr_dist_operations.mod dbcsr_array_list_methods.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_block.F dbcsr_tensor_block.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tensor_block.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_tensor_block.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tensor_block.mod' due to: dbcsr_tensor_block.o true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor_reshape.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_reshape.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tensor_types.mod dbcsr_allocate_wrap.mod dbcsr_tas_base.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_tensor_block.mod dbcsr_api.mod dbcsr_base_hooks.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_reshape.F dbcsr_tensor_reshape.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tensor_reshape.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_tensor_reshape.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tensor_reshape.mod' due to: dbcsr_tensor_reshape.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_reshape.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tensor_types.mod dbcsr_allocate_wrap.mod dbcsr_tas_base.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_tensor_block.mod dbcsr_api.mod dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor_split.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_split.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tensor_types.mod dbcsr_tensor_index.mod dbcsr_allocate_wrap.mod dbcsr_kinds.mod dbcsr_tensor_block.mod dbcsr_api.mod dbcsr_base_hooks.mod dbcsr_array_list_methods.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_split.F dbcsr_tensor_split.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tensor_split.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_tensor_split.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tensor_split.mod' due to: dbcsr_tensor_split.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_split.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tensor_types.mod dbcsr_tensor_index.mod dbcsr_allocate_wrap.mod dbcsr_kinds.mod dbcsr_tensor_block.mod dbcsr_api.mod dbcsr_base_hooks.mod dbcsr_array_list_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor_io.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_io.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tensor_types.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_tensor_block.mod dbcsr_base_hooks.mod dbcsr_tas_io.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_io.F dbcsr_tensor_io.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tensor_io.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_tensor_io.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tensor_io.mod' due to: dbcsr_tensor_io.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_io.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tensor_types.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_tensor_block.mod dbcsr_base_hooks.mod dbcsr_tas_io.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tensor_types.mod dbcsr_tas_types.mod dbcsr_data_types.mod dbcsr_tas_split.mod dbcsr_tensor_reshape.mod dbcsr_dist_operations.mod dbcsr_array_list_methods.mod dbcsr_allocate_wrap.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_base_hooks.mod dbcsr_tas_mm.mod dbcsr_tensor_index.mod dbcsr_tas_base.mod dbcsr_mpiwrap.mod dbcsr_tensor_block.mod dbcsr_tensor_split.mod dbcsr_api.mod dbcsr_tensor_io.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.F dbcsr_tensor.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tensor.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_tensor.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.F:1041:24: 1041 | IF (new_3 .AND. do_write_3) CALL dbcsr_t_write_tensor_info(tensor_3, unit_nr_prv, full_info=log_verbose) | ^ Warning: ‘do_write_3’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.F:981:88: 981 | CALL mp_environ(tensor_large%pgrid%mp_comm_2d, 2, pdims_2d, pcoord_2d, periods_2d) | ^ Warning: ‘tensor_large’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tensor.mod' due to: dbcsr_tensor.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tensor_types.mod dbcsr_tas_types.mod dbcsr_data_types.mod dbcsr_tas_split.mod dbcsr_tensor_reshape.mod dbcsr_dist_operations.mod dbcsr_array_list_methods.mod dbcsr_allocate_wrap.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_base_hooks.mod dbcsr_tas_mm.mod dbcsr_tensor_index.mod dbcsr_tas_base.mod dbcsr_mpiwrap.mod dbcsr_tensor_block.mod dbcsr_tensor_split.mod dbcsr_api.mod dbcsr_tensor_io.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_test.mod' due to: dbcsr_tas_test.o true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor_test.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_test.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_tensor_types.mod dbcsr_tensor_index.mod dbcsr_allocate_wrap.mod dbcsr_tas_base.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_blas_operations.mod dbcsr_base_hooks.mod dbcsr_tensor_block.mod dbcsr_api.mod dbcsr_tensor.mod dbcsr_tas_test.mod dbcsr_tensor_io.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_test.F dbcsr_tensor_test.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tensor_test.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_tensor_test.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_test.F:103:18: 103 | IF (.NOT. blocks_equal(blk_data1, blk_data2)) THEN | ^ Warning: ‘__result_blocks_equal’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_test.F:113:3: 113 | PURE FUNCTION blocks_equal(block1, block2) | ^ note: ‘__result_blocks_equal’ was declared here /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tensor_test.mod' due to: dbcsr_tensor_test.o true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor_api.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_api.F dbcsr_tensor_types.mod dbcsr_tensor_index.mod dbcsr_tensor_block.mod dbcsr_tensor_split.mod dbcsr_tensor.mod dbcsr_tensor_test.mod dbcsr_tensor_io.mod python3 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_api.F dbcsr_tensor_api.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tensor_api.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/' -I'/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src' dbcsr_tensor_api.F90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:329: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a' due to: dbcsr_work_operations.o dbcsr_base_hooks.o dbcsr_machine_internal.o dbcsr_kinds.o dbcsr_machine.o dbcsr_dist_util.o dbcsr_dist_operations.o dbcsr_dist_methods.o dbcsr_mp_operations.o dbcsr_mp_methods.o dbcsr_mpiwrap.o dbcsr_data_methods_low.o dbcsr_data_methods.o dbcsr_data_types.o dbcsr_mem_methods.o dbcsr_ptr_util.o dbcsr_data_operations.o dbcsr_acc_devmem.o dbcsr_acc_stream.o dbcsr_acc_hostmem.o dbcsr_acc_event.o dbcsr_acc_device.o dbcsr_acc_init.o dbcsr_acc_timings.o dbcsr_cuda_profiling.o dbcsr_hipblas.o dbcsr_iter_types.o dbcsr_methods.o dbcsr_lib.o dbcsr_timings_report.o dbcsr_config.o dbcsr_error_handling.o dbcsr_print_messages.o dbcsr_list_callstackentry.o dbcsr_list_routinereport.o dbcsr_list_timerenv.o dbcsr_timings.o dbcsr_list_routinestat.o dbcsr_list.o dbcsr_types.o dbcsr_timings_types.o dbcsr_timings_base_type.o dbcsr_dict.o dbcsr_log_handling.o dbcsr_array_types.o dbcsr_mm_sched.o dbcsr_mm_hostdrv.o dbcsr_mm_dist_operations.o dbcsr_acc_operations.o dbcsr_mm_csr.o dbcsr_mm.o dbcsr_multiply_api.o dbcsr_mm_3d.o dbcsr_mm_accdrv.o dbcsr_mm_common.o dbcsr_mm_cannon.o dbcsr_mm_multrec.o dbcsr_mm_types.o dbcsr_block_operations.o dbcsr_iterator_operations.o dbcsr_block_access.o dbcsr_index_operations.o dbcsr_blas_operations.o dbcsr_toollib.o dbcsr_min_heap.o dbcsr_string_utilities.o dbcsr_array_sort.o dbcsr_files.o dbcsr_btree.o dbcsr_tests.o dbcsr_operations.o dbcsr_io.o dbcsr_transformations.o dbcsr_test_methods.o dbcsr_csr_conversions.o dbcsr_tas_types.o dbcsr_tas_split.o dbcsr_tas_base.o dbcsr_tas_util.o dbcsr_tas_test.o dbcsr_tas_mm.o dbcsr_tas_reshape_ops.o dbcsr_tas_global.o dbcsr_tas_io.o dbcsr_api.o dbcsr_array_list_methods.o dbcsr_tensor_block.o dbcsr_tensor_test.o dbcsr_tensor_index.o dbcsr_allocate_wrap.o dbcsr_tensor_split.o dbcsr_tensor.o dbcsr_tensor_api.o dbcsr_tensor_types.o dbcsr_tensor_reshape.o dbcsr_tensor_io.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a dbcsr_work_operations.o dbcsr_base_hooks.o dbcsr_machine_internal.o dbcsr_kinds.o dbcsr_machine.o dbcsr_dist_util.o dbcsr_dist_operations.o dbcsr_dist_methods.o dbcsr_mp_operations.o dbcsr_mp_methods.o dbcsr_mpiwrap.o dbcsr_data_methods_low.o dbcsr_data_methods.o dbcsr_data_types.o dbcsr_mem_methods.o dbcsr_ptr_util.o dbcsr_data_operations.o dbcsr_acc_devmem.o dbcsr_acc_stream.o dbcsr_acc_hostmem.o dbcsr_acc_event.o dbcsr_acc_device.o dbcsr_acc_init.o dbcsr_acc_timings.o dbcsr_cuda_profiling.o dbcsr_hipblas.o dbcsr_iter_types.o dbcsr_methods.o dbcsr_lib.o dbcsr_timings_report.o dbcsr_config.o dbcsr_error_handling.o dbcsr_print_messages.o dbcsr_list_callstackentry.o dbcsr_list_routinereport.o dbcsr_list_timerenv.o dbcsr_timings.o dbcsr_list_routinestat.o dbcsr_list.o dbcsr_types.o dbcsr_timings_types.o dbcsr_timings_base_type.o dbcsr_dict.o dbcsr_log_handling.o dbcsr_array_types.o dbcsr_mm_sched.o dbcsr_mm_hostdrv.o dbcsr_mm_dist_operations.o dbcsr_acc_operations.o dbcsr_mm_csr.o dbcsr_mm.o dbcsr_multiply_api.o dbcsr_mm_3d.o dbcsr_mm_accdrv.o dbcsr_mm_common.o dbcsr_mm_cannon.o dbcsr_mm_multrec.o dbcsr_mm_types.o dbcsr_block_operations.o dbcsr_iterator_operations.o dbcsr_block_access.o dbcsr_index_operations.o dbcsr_blas_operations.o dbcsr_toollib.o dbcsr_min_heap.o dbcsr_string_utilities.o dbcsr_array_sort.o dbcsr_files.o dbcsr_btree.o dbcsr_tests.o dbcsr_operations.o dbcsr_io.o dbcsr_transformations.o dbcsr_test_methods.o dbcsr_csr_conversions.o dbcsr_tas_types.o dbcsr_tas_split.o dbcsr_tas_base.o dbcsr_tas_util.o dbcsr_tas_test.o dbcsr_tas_mm.o dbcsr_tas_reshape_ops.o dbcsr_tas_global.o dbcsr_tas_io.o dbcsr_api.o dbcsr_array_list_methods.o dbcsr_tensor_block.o dbcsr_tensor_test.o dbcsr_tensor_index.o dbcsr_allocate_wrap.o dbcsr_tensor_split.o dbcsr_tensor.o dbcsr_tensor_api.o dbcsr_tensor_types.o dbcsr_tensor_reshape.o dbcsr_tensor_io.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:144: update target 'all' due to: makedep /usr/bin/make --no-print-directory -C /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp -f /build/cp2k-Q381vr/cp2k-8.1/Makefile all INCLUDE_DEPS=true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'kinds.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/base/kinds.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/base/kinds.F kinds.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:31:20 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"base/kinds.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/base/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kinds.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'kinds.mod' due to: kinds.o /build/cp2k-Q381vr/cp2k-8.1/src/base/kinds.F true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'machine_internal.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/base/machine_internal.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/machine_posix.f90 kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/base/machine_internal.F machine_internal.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:31:20 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"base/machine_internal.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/base/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' machine_internal.F90 /build/cp2k-Q381vr/cp2k-8.1/src/base/machine_posix.f90:33:24: 33 | SUBROUTINE abort() BIND(C, name="abort") | 1 Warning: ‘abort’ declared at (1) may shadow the intrinsic of the same name. In order to call the intrinsic, explicit INTRINSIC declarations may be required. [-Wintrinsic-shadow] /build/cp2k-Q381vr/cp2k-8.1/src/base/machine_posix.f90:65:8: 65 | FUNCTION kill(pid, sig) BIND(C, name="kill") RESULT(errno) | 1 Warning: ‘kill’ declared at (1) may shadow the intrinsic of the same name. In order to call the intrinsic, explicit INTRINSIC declarations may be required. [-Wintrinsic-shadow] /build/cp2k-Q381vr/cp2k-8.1/src/base/machine_posix.f90:237:8: 237 | FUNCTION unlink(path) BIND(C, name="unlink") RESULT(errno) | 1 Warning: ‘unlink’ declared at (1) may shadow the intrinsic of the same name. In order to call the intrinsic, explicit INTRINSIC declarations may be required. [-Wintrinsic-shadow] /build/cp2k-Q381vr/cp2k-8.1/src/base/machine_posix.f90:245:8: 245 | FUNCTION rename(src, dest) BIND(C, name="rename") RESULT(errno) | 1 Warning: ‘rename’ declared at (1) may shadow the intrinsic of the same name. In order to call the intrinsic, explicit INTRINSIC declarations may be required. [-Wintrinsic-shadow] /build/cp2k-Q381vr/cp2k-8.1/src/base/machine_posix.f90:315:8: 315 | FUNCTION getcwd(buf, buflen) BIND(C, name="getcwd") RESULT(stat) | 1 Warning: ‘getcwd’ declared at (1) may shadow the intrinsic of the same name. In order to call the intrinsic, explicit INTRINSIC declarations may be required. [-Wintrinsic-shadow] /build/cp2k-Q381vr/cp2k-8.1/src/base/machine_posix.f90:342:8: 342 | FUNCTION chdir(path) BIND(C, name="chdir") RESULT(errno) | 1 Warning: ‘chdir’ declared at (1) may shadow the intrinsic of the same name. In order to call the intrinsic, explicit INTRINSIC declarations may be required. [-Wintrinsic-shadow] /build/cp2k-Q381vr/cp2k-8.1/src/base/machine_posix.f90:382:8: 382 | FUNCTION getpid() BIND(C, name="getpid") RESULT(pid) | 1 Warning: ‘getpid’ declared at (1) may shadow the intrinsic of the same name. In order to call the intrinsic, explicit INTRINSIC declarations may be required. [-Wintrinsic-shadow] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'machine_internal.mod' due to: machine_internal.o /build/cp2k-Q381vr/cp2k-8.1/src/base/machine_internal.F /build/cp2k-Q381vr/cp2k-8.1/src/base/machine_posix.f90 kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'machine.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/base/machine.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/machine_cpuid.h kinds.mod machine_internal.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/base/machine.F machine.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:31:21 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"base/machine.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/base/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' machine.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'machine.mod' due to: machine.o /build/cp2k-Q381vr/cp2k-8.1/src/base/machine.F /build/cp2k-Q381vr/cp2k-8.1/src/base/machine_cpuid.h kinds.mod machine_internal.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'base_hooks.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/base/base_hooks.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod kinds.mod machine.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/base/base_hooks.F base_hooks.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:31:21 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"base/base_hooks.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/base/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' base_hooks.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'base_hooks.mod' due to: base_hooks.o /build/cp2k-Q381vr/cp2k-8.1/src/base/base_hooks.F kinds.mod machine.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'memory_utilities.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/memory_utilities.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/memory_utilities.F memory_utilities.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:31:22 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/memory_utilities.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' memory_utilities.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'memory_utilities.mod' due to: memory_utilities.o /build/cp2k-Q381vr/cp2k-8.1/src/common/memory_utilities.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'memory_utilities_unittest.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/memory_utilities_unittest.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a kinds.mod memory_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/memory_utilities_unittest.F memory_utilities_unittest.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:31:25 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/memory_utilities_unittest.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' memory_utilities_unittest.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_para_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_para_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_para_types.F cp_para_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:31:25 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_para_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_para_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_para_types.mod' due to: cp_para_types.o /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_para_types.F true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'timings_base_type.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/timings_base_type.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/timings_base_type.F timings_base_type.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:31:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/timings_base_type.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' timings_base_type.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'timings_base_type.mod' due to: timings_base_type.o /build/cp2k-Q381vr/cp2k-8.1/src/common/timings_base_type.F kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'list_callstackentry.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/list_callstackentry.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/common/list.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 timings_base_type.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/list_callstackentry.F list_callstackentry.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:31:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/list_callstackentry.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' list_callstackentry.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'list_callstackentry.mod' due to: list_callstackentry.o /build/cp2k-Q381vr/cp2k-8.1/src/common/list_callstackentry.F /build/cp2k-Q381vr/cp2k-8.1/src/common/list.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 timings_base_type.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'callgraph.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/callgraph.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/common/hash_map.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 timings_base_type.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/callgraph.F callgraph.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:31:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/callgraph.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' callgraph.F90 /build/cp2k-Q381vr/cp2k-8.1/src/common/callgraph.F:17:0: 17 | #:call hash_map(prefix='callgraph', & | Warning: ‘callgraph_isready’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/callgraph.F:17:24: 17 | #:call hash_map(prefix='callgraph', & | ^ Warning: ‘callgraph_del’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/callgraph.F:17:27: 17 | #:call hash_map(prefix='callgraph', & | ^ Warning: ‘callgraph_update’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/callgraph.F:17:26: 17 | #:call hash_map(prefix='callgraph', & | ^ Warning: ‘value’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/common/callgraph.F:17:66: 17 | #:call hash_map(prefix='callgraph', & | ^ note: ‘value’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'callgraph.mod' due to: callgraph.o /build/cp2k-Q381vr/cp2k-8.1/src/common/callgraph.F /build/cp2k-Q381vr/cp2k-8.1/src/common/hash_map.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 timings_base_type.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'routine_map.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/routine_map.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/common/hash_map.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/routine_map.F routine_map.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:31:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/routine_map.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' routine_map.F90 /build/cp2k-Q381vr/cp2k-8.1/src/common/routine_map.F:16:0: 16 | #:call hash_map(prefix='routine_map', & | Warning: ‘routine_map_isready’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/routine_map.F:16:26: 16 | #:call hash_map(prefix='routine_map', & | ^ Warning: ‘routine_map_del’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/routine_map.F:16:29: 16 | #:call hash_map(prefix='routine_map', & | ^ Warning: ‘routine_map_update’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/routine_map.F:16:28: 16 | #:call hash_map(prefix='routine_map', & | ^ Warning: ‘value’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/common/routine_map.F:16:68: 16 | #:call hash_map(prefix='routine_map', & | ^ note: ‘value’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'routine_map.mod' due to: routine_map.o /build/cp2k-Q381vr/cp2k-8.1/src/common/routine_map.F /build/cp2k-Q381vr/cp2k-8.1/src/common/hash_map.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'list_routinestat.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/list_routinestat.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/common/list.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 timings_base_type.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/list_routinestat.F list_routinestat.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:31:28 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/list_routinestat.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' list_routinestat.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'list_routinestat.mod' due to: list_routinestat.o /build/cp2k-Q381vr/cp2k-8.1/src/common/list_routinestat.F /build/cp2k-Q381vr/cp2k-8.1/src/common/list.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 timings_base_type.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'timings_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/timings_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod list_callstackentry.mod callgraph.mod routine_map.mod list_routinestat.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/timings_types.F timings_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:31:28 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/timings_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' timings_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'timings_types.mod' due to: timings_types.o /build/cp2k-Q381vr/cp2k-8.1/src/common/timings_types.F list_callstackentry.mod callgraph.mod routine_map.mod list_routinestat.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cuda_profiling.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/cuda_profiling.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/cuda_profiling.F cuda_profiling.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:31:29 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cuda_profiling.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cuda_profiling.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cuda_profiling.mod' due to: cuda_profiling.o /build/cp2k-Q381vr/cp2k-8.1/src/common/cuda_profiling.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'list_routinereport.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/list_routinereport.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/common/list.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 timings_base_type.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/list_routinereport.F list_routinereport.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:31:29 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/list_routinereport.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' list_routinereport.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'list_routinereport.mod' due to: list_routinereport.o /build/cp2k-Q381vr/cp2k-8.1/src/common/list_routinereport.F /build/cp2k-Q381vr/cp2k-8.1/src/common/list.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 timings_base_type.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'list_timerenv.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/list_timerenv.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/common/list.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 timings_types.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/list_timerenv.F list_timerenv.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:31:29 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/list_timerenv.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' list_timerenv.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'list_timerenv.mod' due to: list_timerenv.o /build/cp2k-Q381vr/cp2k-8.1/src/common/list_timerenv.F /build/cp2k-Q381vr/cp2k-8.1/src/common/list.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 timings_types.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'list.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/list.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/common/list.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 timings_base_type.mod base_hooks.mod list_routinereport.mod list_timerenv.mod list_routinestat.mod list_callstackentry.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/list.F list.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:31:30 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/list.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' list.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'list.mod' due to: list.o /build/cp2k-Q381vr/cp2k-8.1/src/common/list.F /build/cp2k-Q381vr/cp2k-8.1/src/common/list.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 timings_base_type.mod base_hooks.mod list_routinereport.mod list_timerenv.mod list_routinestat.mod list_callstackentry.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'timings.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/timings.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 timings_base_type.mod timings_types.mod base_hooks.mod kinds.mod cuda_profiling.mod list.mod callgraph.mod machine.mod routine_map.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/timings.F timings.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:31:30 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/timings.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' timings.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'timings.mod' due to: timings.o /build/cp2k-Q381vr/cp2k-8.1/src/common/timings.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 timings_base_type.mod timings_types.mod base_hooks.mod kinds.mod cuda_profiling.mod list.mod callgraph.mod machine.mod routine_map.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_array_sort.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_array_sort.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/common/array_sort.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_array_sort.F cp_array_sort.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:31:31 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_array_sort.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_array_sort.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_array_sort.mod' due to: cp_array_sort.o /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_array_sort.F /build/cp2k-Q381vr/cp2k-8.1/src/common/array_sort.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/util.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/common/sort_m.f90 cp_array_sort.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/util.F util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:31:32 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' util.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'util.mod' due to: util.o /build/cp2k-Q381vr/cp2k-8.1/src/common/util.F /build/cp2k-Q381vr/cp2k-8.1/src/common/sort_m.f90 cp_array_sort.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'message_passing.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod machine.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.F message_passing.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:31:34 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mpiwrap/message_passing.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' message_passing.F90 /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.F:3358:33: 3358 | SUBROUTINE mp_file_read_at_chv(fh, offset, msg, msglen) | ^ Warning: ‘mp_file_read_at_chv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.F:3386:32: 3386 | SUBROUTINE mp_file_read_at_ch(fh, offset, msg) | ^ Warning: ‘mp_file_read_at_ch’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.F:3595:28: 3595 | SUBROUTINE mp_type_free_v(type_descriptors) | ^ Warning: ‘mp_type_free_v’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:1410:22: 1410 | SUBROUTINE mp_prod_${nametype1}$ (msg, gid) | ^ Warning: ‘mp_prod_i’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:1442:26: 1442 | SUBROUTINE mp_scatter_${nametype1}$v(msg_scatter, msg, root, gid) | ^ Warning: ‘mp_scatter_iv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:1785:27: 1785 | SUBROUTINE mp_igatherv_${nametype1}$v(sendbuf, sendcount, recvbuf, recvcounts, displs, root, comm, request) | ^ Warning: ‘mp_igatherv_iv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:2554:30: 2554 | SUBROUTINE mp_sum_scatter_${nametype1}$v(msgout, msgin, rcount, gid) | ^ Warning: ‘mp_sum_scatter_iv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:3526:2: 3526 | FUNCTION mp_type_indexed_make_${nametype1}$ (count, lengths, displs) & | ^ Warning: ‘mp_type_indexed_make_i’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:3755:31: 3755 | SUBROUTINE mp_file_read_at_${nametype1}$v(fh, offset, msg, msglen) | ^ Warning: ‘mp_file_read_at_iv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:3784:30: 3784 | SUBROUTINE mp_file_read_at_${nametype1}$ (fh, offset, msg) | ^ Warning: ‘mp_file_read_at_i’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:1410:22: 1410 | SUBROUTINE mp_prod_${nametype1}$ (msg, gid) | ^ Warning: ‘mp_prod_l’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:1442:26: 1442 | SUBROUTINE mp_scatter_${nametype1}$v(msg_scatter, msg, root, gid) | ^ Warning: ‘mp_scatter_lv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:1785:27: 1785 | SUBROUTINE mp_igatherv_${nametype1}$v(sendbuf, sendcount, recvbuf, recvcounts, displs, root, comm, request) | ^ Warning: ‘mp_igatherv_lv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:2554:30: 2554 | SUBROUTINE mp_sum_scatter_${nametype1}$v(msgout, msgin, rcount, gid) | ^ Warning: ‘mp_sum_scatter_lv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:3526:2: 3526 | FUNCTION mp_type_indexed_make_${nametype1}$ (count, lengths, displs) & | ^ Warning: ‘mp_type_indexed_make_l’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:3755:31: 3755 | SUBROUTINE mp_file_read_at_${nametype1}$v(fh, offset, msg, msglen) | ^ Warning: ‘mp_file_read_at_lv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:3784:30: 3784 | SUBROUTINE mp_file_read_at_${nametype1}$ (fh, offset, msg) | ^ Warning: ‘mp_file_read_at_l’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:1442:26: 1442 | SUBROUTINE mp_scatter_${nametype1}$v(msg_scatter, msg, root, gid) | ^ Warning: ‘mp_scatter_dv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:1785:27: 1785 | SUBROUTINE mp_igatherv_${nametype1}$v(sendbuf, sendcount, recvbuf, recvcounts, displs, root, comm, request) | ^ Warning: ‘mp_igatherv_dv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:2554:30: 2554 | SUBROUTINE mp_sum_scatter_${nametype1}$v(msgout, msgin, rcount, gid) | ^ Warning: ‘mp_sum_scatter_dv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:3755:31: 3755 | SUBROUTINE mp_file_read_at_${nametype1}$v(fh, offset, msg, msglen) | ^ Warning: ‘mp_file_read_at_dv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:3784:30: 3784 | SUBROUTINE mp_file_read_at_${nametype1}$ (fh, offset, msg) | ^ Warning: ‘mp_file_read_at_d’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:1442:26: 1442 | SUBROUTINE mp_scatter_${nametype1}$v(msg_scatter, msg, root, gid) | ^ Warning: ‘mp_scatter_rv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:1785:27: 1785 | SUBROUTINE mp_igatherv_${nametype1}$v(sendbuf, sendcount, recvbuf, recvcounts, displs, root, comm, request) | ^ Warning: ‘mp_igatherv_rv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:2554:30: 2554 | SUBROUTINE mp_sum_scatter_${nametype1}$v(msgout, msgin, rcount, gid) | ^ Warning: ‘mp_sum_scatter_rv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:3755:31: 3755 | SUBROUTINE mp_file_read_at_${nametype1}$v(fh, offset, msg, msglen) | ^ Warning: ‘mp_file_read_at_rv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:3784:30: 3784 | SUBROUTINE mp_file_read_at_${nametype1}$ (fh, offset, msg) | ^ Warning: ‘mp_file_read_at_r’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:1442:26: 1442 | SUBROUTINE mp_scatter_${nametype1}$v(msg_scatter, msg, root, gid) | ^ Warning: ‘mp_scatter_zv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:1785:27: 1785 | SUBROUTINE mp_igatherv_${nametype1}$v(sendbuf, sendcount, recvbuf, recvcounts, displs, root, comm, request) | ^ Warning: ‘mp_igatherv_zv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:2554:30: 2554 | SUBROUTINE mp_sum_scatter_${nametype1}$v(msgout, msgin, rcount, gid) | ^ Warning: ‘mp_sum_scatter_zv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:3755:31: 3755 | SUBROUTINE mp_file_read_at_${nametype1}$v(fh, offset, msg, msglen) | ^ Warning: ‘mp_file_read_at_zv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:3784:30: 3784 | SUBROUTINE mp_file_read_at_${nametype1}$ (fh, offset, msg) | ^ Warning: ‘mp_file_read_at_z’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:1442:26: 1442 | SUBROUTINE mp_scatter_${nametype1}$v(msg_scatter, msg, root, gid) | ^ Warning: ‘mp_scatter_cv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:1785:27: 1785 | SUBROUTINE mp_igatherv_${nametype1}$v(sendbuf, sendcount, recvbuf, recvcounts, displs, root, comm, request) | ^ Warning: ‘mp_igatherv_cv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:2554:30: 2554 | SUBROUTINE mp_sum_scatter_${nametype1}$v(msgout, msgin, rcount, gid) | ^ Warning: ‘mp_sum_scatter_cv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:3755:31: 3755 | SUBROUTINE mp_file_read_at_${nametype1}$v(fh, offset, msg, msglen) | ^ Warning: ‘mp_file_read_at_cv’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90:3784:30: 3784 | SUBROUTINE mp_file_read_at_${nametype1}$ (fh, offset, msg) | ^ Warning: ‘mp_file_read_at_c’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'message_passing.mod' due to: message_passing.o /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.F /build/cp2k-Q381vr/cp2k-8.1/src/mpiwrap/message_passing.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod machine.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_files.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_files.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod machine.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_files.F cp_files.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:32:08 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_files.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_files.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_files.mod' due to: cp_files.o /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_files.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod machine.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'timings_report.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/timings_report.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod timings_base_type.mod timings_types.mod base_hooks.mod kinds.mod timings.mod list_routinereport.mod util.mod list.mod callgraph.mod message_passing.mod cp_files.mod routine_map.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/timings_report.F timings_report.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:32:09 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/timings_report.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' timings_report.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'string_utilities.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/string_utilities.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/string_utilities.F string_utilities.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:32:10 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/string_utilities.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' string_utilities.F90 /build/cp2k-Q381vr/cp2k-8.1/src/common/string_utilities.F:24:45: 24 | CHARACTER(LEN=1), PARAMETER :: backslash = '\\' | 1 Warning: CHARACTER expression at (1) is being truncated (2/1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/common/string_utilities.F:3168:3: 3168 | PURE FUNCTION s2a_60(s1, s2, s3, s4, s5, s6, s7, s8, s9, s10, & | ^ Warning: ‘s2a_60’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'string_utilities.mod' due to: string_utilities.o /build/cp2k-Q381vr/cp2k-8.1/src/common/string_utilities.F kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'parallel_rng_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/parallel_rng_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod string_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/parallel_rng_types.F parallel_rng_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:32:43 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/parallel_rng_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' parallel_rng_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/common/parallel_rng_types.F:845:25: 845 | END FUNCTION next_real | ^ Warning: ‘u’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/common/parallel_rng_types.F:804:47: 804 | FUNCTION next_real(self, variance) RESULT(u) | ^ note: ‘u’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'parallel_rng_types.mod' due to: parallel_rng_types.o /build/cp2k-Q381vr/cp2k-8.1/src/common/parallel_rng_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod string_utilities.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_para_env.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_para_env.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod base_hooks.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_para_env.F cp_para_env.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:32:44 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_para_env.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_para_env.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_para_env.mod' due to: cp_para_env.o /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_para_env.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod base_hooks.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_iter_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_iter_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_iter_types.F cp_iter_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:32:45 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_iter_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_iter_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_iter_types.mod' due to: cp_iter_types.o /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_iter_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_log_handling.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_log_handling.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_iter_types.mod base_hooks.mod kinds.mod timings.mod machine.mod string_utilities.mod message_passing.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_log_handling.F cp_log_handling.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:32:45 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_log_handling.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_log_handling.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_log_handling.mod' due to: cp_log_handling.o /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_log_handling.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_iter_types.mod base_hooks.mod kinds.mod timings.mod machine.mod string_utilities.mod message_passing.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_array_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_array_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_array_utils.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod cp_log_handling.mod kinds.mod machine.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_array_utils.F cp_array_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:32:46 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_array_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_array_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_array_utils.mod' due to: cp_array_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_array_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_array_utils.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod cp_log_handling.mod kinds.mod machine.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'distribution_1d_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/distribution_1d_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod cp_para_env.mod base_hooks.mod cp_array_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/distribution_1d_types.F distribution_1d_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:32:47 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/distribution_1d_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' distribution_1d_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mathconstants.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/mathconstants.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/mathconstants.F mathconstants.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:32:48 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/mathconstants.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mathconstants.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mathconstants.mod' due to: mathconstants.o /build/cp2k-Q381vr/cp2k-8.1/src/common/mathconstants.F kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'bessel_lib.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/bessel_lib.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/bessel_lib.F bessel_lib.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:32:48 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/bessel_lib.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' bessel_lib.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'lapack.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/lapack.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/lapack.F lapack.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:32:48 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/lapack.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lapack.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'lebedev.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/lebedev.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/lebedev.F lebedev.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:32:48 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/lebedev.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lebedev.F90 /build/cp2k-Q381vr/cp2k-8.1/src/common/lebedev.F:146:42: 146 | END FUNCTION get_number_of_lebedev_grid | ^ Warning: ‘number_of_lebedev_grid’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/common/lebedev.F:113:75: 113 | FUNCTION get_number_of_lebedev_grid(l, n) RESULT(number_of_lebedev_grid) | ^ note: ‘number_of_lebedev_grid’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'lebedev.mod' due to: lebedev.o /build/cp2k-Q381vr/cp2k-8.1/src/common/lebedev.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'spherical_harmonics.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/spherical_harmonics.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/spherical_harmonics.F spherical_harmonics.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:32:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/spherical_harmonics.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' spherical_harmonics.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'spherical_harmonics.mod' due to: spherical_harmonics.o /build/cp2k-Q381vr/cp2k-8.1/src/common/spherical_harmonics.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cg_test.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/cg_test.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod cp_log_handling.mod kinds.mod mathconstants.mod lebedev.mod machine.mod spherical_harmonics.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/cg_test.F cg_test.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:32:53 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cg_test.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cg_test.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mathlib.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/mathlib.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/mathlib.F mathlib.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:32:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/mathlib.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mathlib.F90 /build/cp2k-Q381vr/cp2k-8.1/src/common/mathlib.F:1484:3: 1484 | FUNCTION expint(n, x) | ^ Warning: ‘__result_expint’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/common/mathlib.F:143:23: 143 | END FUNCTION pswitch | ^ Warning: ‘fx’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/common/mathlib.F:100:46: 100 | FUNCTION pswitch(x, a, b, order) RESULT(fx) | ^ note: ‘fx’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'kahan_sum.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/kahan_sum.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/kahan_sum.F kahan_sum.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:32:59 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/kahan_sum.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kahan_sum.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'reference_manager.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/reference_manager.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod base_hooks.mod kinds.mod util.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/reference_manager.F reference_manager.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:06 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/reference_manager.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' reference_manager.F90 /build/cp2k-Q381vr/cp2k-8.1/src/common/reference_manager.F:721:40: 721 | res = thebib(key)%ref%citation_key | 1 Warning: CHARACTER expression will be truncated in assignment (80/128) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'string_table.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/string_table.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/string_table.F string_table.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:08 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/string_table.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' string_table.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'lapack.mod' due to: lapack.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'splines.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/splines.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod lapack.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/splines.F splines.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:08 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/splines.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' splines.F90 /build/cp2k-Q381vr/cp2k-8.1/src/common/splines.F:261:27: 261 | SUBROUTINE spline3valder(x, xi, c, val, der) | ^ Warning: ‘spline3valder’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'reference_manager.mod' due to: reference_manager.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'bibliography.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/bibliography.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod string_utilities.mod reference_manager.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/bibliography.F bibliography.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:09 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/bibliography.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' bibliography.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_min_heap.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_min_heap.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_min_heap.F cp_min_heap.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:14 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_min_heap.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_min_heap.F90 /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_min_heap.F:73:3: 73 | ELEMENTAL FUNCTION get_right_child(n) RESULT(child) | ^ Warning: ‘get_right_child’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_min_heap.F:100:3: 100 | ELEMENTAL FUNCTION get_value_by_key(heap, key) RESULT(value) | ^ Warning: ‘get_value_by_key’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'structure_factor_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/structure_factor_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/structure_factor_types.F structure_factor_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:15 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/structure_factor_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' structure_factor_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'structure_factor_types.mod' due to: structure_factor_types.o /build/cp2k-Q381vr/cp2k-8.1/src/common/structure_factor_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'structure_factors.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/structure_factors.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 structure_factor_types.mod base_hooks.mod mathconstants.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/structure_factors.F structure_factors.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:15 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/structure_factors.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' structure_factors.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'periodic_table.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/periodic_table.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod string_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/periodic_table.F periodic_table.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:16 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/periodic_table.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' periodic_table.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fparser.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/fparser.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/fparser.F fparser.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:24 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/fparser.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fparser.F90 /build/cp2k-Q381vr/cp2k-8.1/src/common/fparser.F:355:3: 355 | FUNCTION EvalErrMsg() RESULT(msg) | ^ Warning: ‘evalerrmsg’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/fparser.F:504:36: 504 | IF (PRESENT(inext)) inext = in | ^ Warning: ‘in’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/common/fparser.F:503:38: 503 | IF (PRESENT(ibegin)) ibegin = ib | ^ Warning: ‘ib’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/common/fparser.F:1027:23: 1027 | vals(ipar) = xval | ^ Warning: ‘xval’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'linear_systems.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/linear_systems.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod lapack.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/linear_systems.F linear_systems.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/linear_systems.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' linear_systems.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'physcon.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/physcon.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod mathconstants.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/physcon.F physcon.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/physcon.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' physcon.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'gamma.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/gamma.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/gamma.F gamma.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/gamma.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' gamma.F90 /build/cp2k-Q381vr/cp2k-8.1/src/common/gamma.F:281:22: 281 | SUBROUTINE fgamma_1(nmax, t, f) | ^ Warning: ‘fgamma_1’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 't_c_g0.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/t_c_g0.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/t_c_g0.F t_c_g0.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/t_c_g0.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' t_c_g0.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'whittaker.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/whittaker.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/whittaker.F whittaker.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:29 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/whittaker.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' whittaker.F90 /build/cp2k-Q381vr/cp2k-8.1/src/common/whittaker.F:111:26: 111 | SUBROUTINE whittaker_c0(wc, r, expa, erfa, alpha, l, n) | ^ Warning: ‘whittaker_c0’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'physcon.mod' due to: physcon.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_units.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_units.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod cp_log_handling.mod kinds.mod mathconstants.mod physcon.mod string_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_units.F cp_units.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:30 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_units.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_units.F90 /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_units.F:443:31: 443 | desc = cp_unit_desc(unit) | 1 Warning: CHARACTER expression will be truncated in assignment (80/120) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_units.F:1336:32: 1336 | SUBROUTINE cp_unit_set_retain(unit_set) | ^ Warning: ‘cp_unit_set_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'print_messages.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/print_messages.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/print_messages.F print_messages.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:33 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/print_messages.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' print_messages.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'print_messages.mod' due to: print_messages.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_error_handling.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_error_handling.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod base_hooks.mod cp_log_handling.mod kinds.mod timings.mod machine.mod message_passing.mod print_messages.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_error_handling.F cp_error_handling.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:33 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_error_handling.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_error_handling.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'powell.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/powell.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/powell.F powell.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:34 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/powell.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' powell.F90 /build/cp2k-Q381vr/cp2k-8.1/src/common/powell.F:1608:34: 1608 | tempb = tempb - taumax | ^ Warning: ‘tempb’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/common/powell.F:1850:32: 1850 | tempb = tempb - qmin | ^ Warning: ‘tempb’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/common/powell.F:1665:66: 1665 | reduc, sg, sgk, shs, ss, sth, temp, tempa, tempb | ^ note: ‘tempb’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/common/powell.F:1824:30: 1824 | cf = half*(shs - dhd) | ^ Warning: ‘shs’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/common/powell.F:1665:37: 1665 | reduc, sg, sgk, shs, ss, sth, temp, tempa, tempb | ^ note: ‘shs’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/common/powell.F:1835:57: 1835 | qnew = (sg + cf*cth)*cth + (dg + dhs*cth)*sth | ^ Warning: ‘sg’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/common/powell.F:1665:27: 1665 | reduc, sg, sgk, shs, ss, sth, temp, tempa, tempb | ^ note: ‘sg’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/common/powell.F:1742:49: 1742 | qadd = alpha*(gg - half*alpha*dhd) | ^ Warning: ‘bstep’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/common/powell.F:1663:46: 1663 | REAL(dp) :: alpha, angle, angtest, bstep, cf, cth, dd, delsq, dg, dhd, & | ^ note: ‘bstep’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_result_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_result_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_result_types.F cp_result_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:43 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_result_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_result_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_result_types.mod' due to: cp_result_types.o /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_result_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_result_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_result_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_result_types.mod base_hooks.mod kinds.mod memory_utilities.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_result_methods.F cp_result_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:44 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_result_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_result_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_result_methods.F:271:17: 271 | CPASSERT(nrep*size_res == size_values) | ^ Warning: ‘size_res’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_result_methods.F:199:17: 199 | CPASSERT(nrep*size_res == size_values) | ^ Warning: ‘size_res’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'd3_poly.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/d3_poly.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/d3_poly.F d3_poly.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:46 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/d3_poly.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' d3_poly.F90 /build/cp2k-Q381vr/cp2k-8.1/src/common/d3_poly.F:235:3: 235 | PURE FUNCTION mono_index1(i) RESULT(res) | ^ Warning: ‘mono_index1’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/d3_poly.F:281:3: 281 | PURE FUNCTION mono_exp1(ii) RESULT(res) | ^ Warning: ‘mono_exp1’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/d3_poly.F:332:3: 332 | PURE FUNCTION mono_mult1(ii, ij) RESULT(res) | ^ Warning: ‘mono_mult1’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/d3_poly.F:345:3: 345 | PURE FUNCTION mono_mult2(ii, ij) RESULT(res) | ^ Warning: ‘mono_mult2’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/d3_poly.F:361:3: 361 | PURE FUNCTION mono_mult3(ii, ij) RESULT(res) | ^ Warning: ‘mono_mult3’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/d3_poly.F:379:24: 379 | SUBROUTINE poly_mult1(p1, p2, pRes, np1, sumUp) | ^ Warning: ‘poly_mult1’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/d3_poly.F:424:24: 424 | SUBROUTINE poly_mult2(p1, p2, pRes, np1, sumUp) | ^ Warning: ‘poly_mult2’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/d3_poly.F:502:24: 502 | SUBROUTINE poly_mult3(p1, p2, pRes, np1, sumUp) | ^ Warning: ‘poly_mult3’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/d3_poly.F:736:25: 736 | SUBROUTINE poly_write1(p, out_f) | ^ Warning: ‘poly_write1’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/d3_poly.F:760:25: 760 | SUBROUTINE poly_write2(p, out_f) | ^ Warning: ‘poly_write2’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/d3_poly.F:788:25: 788 | SUBROUTINE poly_write3(p, out_f) | ^ Warning: ‘poly_write3’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/d3_poly.F:820:3: 820 | FUNCTION poly_random(p, maxSize, minSize) RESULT(res) | ^ Warning: ‘poly_random’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/d3_poly.F:1173:26: 1173 | SUBROUTINE poly_p_eval3(p, x, pRes, npoly) | ^ Warning: ‘poly_p_eval3’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/d3_poly.F:1277:31: 1277 | SUBROUTINE poly_padd_uneval3(p, x, pRes, npoly) | ^ Warning: ‘poly_padd_uneval3’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/d3_poly.F:1380:26: 1380 | SUBROUTINE poly_p_eval2(p, x, pRes, npoly) | ^ Warning: ‘poly_p_eval2’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/d3_poly.F:1479:31: 1479 | SUBROUTINE poly_padd_uneval2(p, x, pRes, npoly) | ^ Warning: ‘poly_padd_uneval2’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/d3_poly.F:1577:24: 1577 | SUBROUTINE poly_eval1(p, x, pRes, npoly) | ^ Warning: ‘poly_eval1’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/d3_poly.F:1611:24: 1611 | SUBROUTINE poly_eval2(p, x, y, pRes, npoly) | ^ Warning: ‘poly_eval2’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/d3_poly.F:1678:24: 1678 | SUBROUTINE poly_eval3(p, x, y, z, pRes, npoly) | ^ Warning: ‘poly_eval3’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/d3_poly.F:1751:26: 1751 | SUBROUTINE poly_derive3(p, pRes, npoly, sumUp) | ^ Warning: ‘poly_derive3’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'eigenvalueproblems.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/eigenvalueproblems.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod lapack.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/eigenvalueproblems.F eigenvalueproblems.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:48 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/eigenvalueproblems.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eigenvalueproblems.F90 /build/cp2k-Q381vr/cp2k-8.1/src/common/eigenvalueproblems.F:146:25: 146 | SUBROUTINE cp2k_sgesvd(matrix, svalues, mrow, ncol, uvec, vtvec) | ^ Warning: ‘cp2k_sgesvd’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/common/eigenvalueproblems.F:180:25: 180 | SUBROUTINE cp2k_cgesvd(matrix, svalues, mrow, ncol, uvec, vtvec) | ^ Warning: ‘cp2k_cgesvd’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 't_sh_p_s_c.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/t_sh_p_s_c.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/t_sh_p_s_c.F t_sh_p_s_c.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:49 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/t_sh_p_s_c.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' t_sh_p_s_c.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a' due to: timings_report.o distribution_1d_types.o cp_para_env.o bessel_lib.o lapack.o cg_test.o mathlib.o routine_map.o kahan_sum.o cp_array_utils.o reference_manager.o list_routinereport.o string_table.o splines.o string_utilities.o timings.o bibliography.o cp_min_heap.o structure_factors.o periodic_table.o fparser.o mathconstants.o list_routinestat.o memory_utilities.o linear_systems.o physcon.o gamma.o cp_para_types.o cp_files.o t_c_g0.o whittaker.o cp_units.o list_callstackentry.o timings_base_type.o structure_factor_types.o print_messages.o cp_error_handling.o timings_types.o lebedev.o list.o util.o powell.o cp_result_methods.o cp_array_sort.o list_timerenv.o cuda_profiling.o cp_log_handling.o d3_poly.o cp_result_types.o eigenvalueproblems.o parallel_rng_types.o spherical_harmonics.o cp_iter_types.o t_sh_p_s_c.o callgraph.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a timings_report.o distribution_1d_types.o cp_para_env.o bessel_lib.o lapack.o cg_test.o mathlib.o routine_map.o kahan_sum.o cp_array_utils.o reference_manager.o list_routinereport.o string_table.o splines.o string_utilities.o timings.o bibliography.o cp_min_heap.o structure_factors.o periodic_table.o fparser.o mathconstants.o list_routinestat.o memory_utilities.o linear_systems.o physcon.o gamma.o cp_para_types.o cp_files.o t_c_g0.o whittaker.o cp_units.o list_callstackentry.o timings_base_type.o structure_factor_types.o print_messages.o cp_error_handling.o timings_types.o lebedev.o list.o util.o powell.o cp_result_methods.o cp_array_sort.o list_timerenv.o cuda_profiling.o cp_log_handling.o d3_poly.o cp_result_types.o eigenvalueproblems.o parallel_rng_types.o spherical_harmonics.o cp_iter_types.o t_sh_p_s_c.o callgraph.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmpiwrap.a' due to: message_passing.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmpiwrap.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmpiwrap.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmpiwrap.a message_passing.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmpiwrap.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'machine_cpuid.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/base/machine_cpuid.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/machine_cpuid.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/base/machine_cpuid.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a' due to: machine.o kinds.o base_hooks.o machine_internal.o machine_cpuid.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a machine.o kinds.o base_hooks.o machine_internal.o machine_cpuid.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/all.dep:139: update target '/build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran/memory_utilities_unittest.psmp' due to: memory_utilities_unittest.o /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmpiwrap.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:52 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran/memory_utilities_unittest.psmp memory_utilities_unittest.o -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'parallel_rng_types_unittest.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/common/parallel_rng_types_unittest.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a parallel_rng_types.mod kinds.mod message_passing.mod machine.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/common/parallel_rng_types_unittest.F parallel_rng_types_unittest.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:52 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/parallel_rng_types_unittest.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/common/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' parallel_rng_types_unittest.F90 /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/all.dep:135: update target '/build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran/parallel_rng_types_unittest.psmp' due to: parallel_rng_types_unittest.o /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmpiwrap.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:53 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran/parallel_rng_types_unittest.psmp parallel_rng_types_unittest.o -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'grid_miniapp.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_miniapp.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_replay.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_library.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_sphere_cache.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_miniapp.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pw_grid_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_grid_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_grid_types.F pw_grid_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:53 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_grid_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_grid_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pw_grid_types.mod' due to: pw_grid_types.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_grid_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mathlib.mod' due to: mathlib.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fft_kinds.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/fft_kinds.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/fft_kinds.F fft_kinds.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/fft/fft_kinds.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fft_kinds.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fft_kinds.mod' due to: fft_kinds.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/fft_kinds.F true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fft_plan.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/fft_plan.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod fft_kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/fft_plan.F fft_plan.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/fft/fft_plan.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fft_plan.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fft_plan.mod' due to: fft_plan.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/fft_plan.F fft_kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fftw3_lib.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/fftw3_lib.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod fft_kinds.mod fft_plan.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/fftw3_lib.F fftw3_lib.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/fft/fftw3_lib.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fftw3_lib.F90 /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/fftw3_lib.F:1077:71: 1077 | scal_offset | ^ Warning: ‘scal_offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/fftw3_lib.F:1123:99: 1123 | IF (scale /= 1.0_dp) CALL zdscal(plan%n*num_rows, scale, zout(scal_offset:scal_offset), 1) | ^ Warning: ‘num_rows’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/fftw3_lib.F:1076:86: 1076 | INTEGER :: in_offset, my_id, num_rows, out_offset, & | ^ note: ‘num_rows’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fftw3_lib.mod' due to: fftw3_lib.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/fftw3_lib.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod fft_kinds.mod fft_plan.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mltfftsg_tools.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/mltfftsg_tools.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 fft_kinds.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/mltfftsg_tools.F mltfftsg_tools.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:33:56 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/fft/mltfftsg_tools.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mltfftsg_tools.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mltfftsg_tools.mod' due to: mltfftsg_tools.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/mltfftsg_tools.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 fft_kinds.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fftsg_lib.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/fftsg_lib.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod mltfftsg_tools.mod fft_kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/fftsg_lib.F fftsg_lib.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:34:09 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/fft/fftsg_lib.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fftsg_lib.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fftsg_lib.mod' due to: fftsg_lib.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/fftsg_lib.F mltfftsg_tools.mod fft_kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fft_lib.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/fft_lib.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod fft_kinds.mod fftw3_lib.mod fftsg_lib.mod fft_plan.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/fft_lib.F fft_lib.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:34:09 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/fft/fft_lib.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fft_lib.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fft_lib.mod' due to: fft_lib.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft/fft_lib.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod fft_kinds.mod fftw3_lib.mod fftsg_lib.mod fft_plan.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fast.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/fast.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod mathconstants.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/fast.F fast.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:34:10 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/fast.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fast.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fast.mod' due to: fast.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/fast.F mathconstants.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fft_tools.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft_tools.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod base_hooks.mod fft_lib.mod cp_log_handling.mod kinds.mod fast.mod fft_plan.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft_tools.F fft_tools.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:34:12 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/fft_tools.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fft_tools.F90 /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft_tools.F:3286:64: 3286 | fft_scratch_last%fft_scratch_next => fft_scratch_new | ^ Warning: ‘fft_scratch_last’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fft_tools.mod' due to: fft_tools.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/fft_tools.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod base_hooks.mod fft_lib.mod cp_log_handling.mod kinds.mod fast.mod fft_plan.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pw_grid_info.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_grid_info.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod base_hooks.mod kinds.mod fft_tools.mod mathconstants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_grid_info.F pw_grid_info.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:34:31 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_grid_info.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_grid_info.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pw_grid_info.mod' due to: pw_grid_info.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_grid_info.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod base_hooks.mod kinds.mod fft_tools.mod mathconstants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pw_grids.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_grids.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod base_hooks.mod kinds.mod mathlib.mod util.mod mathconstants.mod message_passing.mod pw_grid_info.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_grids.F pw_grids.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:34:32 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_grids.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_grids.F90 /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_grids.F:1429:29: 1429 | DO n = nlim(1), nlim(2) | ^ Warning: ‘nlim[0]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_grids.F:1429:29: Warning: ‘nlim[1]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_grids.F:1024:17: 1024 | .OR. .NOT. blocking) THEN | ^ Warning: ‘blocking’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_grids.F:822:68: 822 | LOGICAL :: blocking | ^ note: ‘blocking’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_grids.F:1421:44: 1421 | n = n_upperlimit - bounds(1, 3) + 1 | ^ Warning: ‘n_upperlimit’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_grids.F:1400:85: 1400 | INTEGER :: l, m, mm, n, n_upperlimit, nlim(2), nn | ^ note: ‘n_upperlimit’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pw_grids.mod' due to: pw_grids.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_grids.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod base_hooks.mod kinds.mod mathlib.mod util.mod mathconstants.mod message_passing.mod pw_grid_info.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pw_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod base_hooks.mod timings.mod cp_log_handling.mod kinds.mod pw_grids.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_types.F pw_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:34:38 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pw_types.mod' due to: pw_types.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod base_hooks.mod timings.mod cp_log_handling.mod kinds.mod pw_grids.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'kahan_sum.mod' due to: kahan_sum.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pw_fpga.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_fpga.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_fpga.F pw_fpga.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:34:39 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_fpga.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_fpga.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pw_fpga.mod' due to: pw_fpga.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_fpga.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pw_cuda.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_cuda.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod base_hooks.mod kinds.mod fft_tools.mod message_passing.mod fast.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_cuda.F pw_cuda.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:34:39 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_cuda.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_cuda.F90 /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_cuda.F:770:25: 770 | SUBROUTINE pw_cuda_cff(pw1, pwbuf) | ^ Warning: ‘pw_cuda_cff’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_cuda.F:811:25: 811 | SUBROUTINE pw_cuda_ffc(pwbuf, pw2) | ^ Warning: ‘pw_cuda_ffc’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_cuda.F:852:24: 852 | SUBROUTINE pw_cuda_cf(pw1, pwbuf) | ^ Warning: ‘pw_cuda_cf’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_cuda.F:893:24: 893 | SUBROUTINE pw_cuda_fc(pwbuf, pw2) | ^ Warning: ‘pw_cuda_fc’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_cuda.F:936:23: 936 | SUBROUTINE pw_cuda_f(pwbuf1, pwbuf2, dir, n, m) | ^ Warning: ‘pw_cuda_f’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_cuda.F:979:24: 979 | SUBROUTINE pw_cuda_fg(pwbuf, pw2, scale) | ^ Warning: ‘pw_cuda_fg’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_cuda.F:1029:24: 1029 | SUBROUTINE pw_cuda_sf(pw1, pwbuf, scale) | ^ Warning: ‘pw_cuda_sf’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pw_cuda.mod' due to: pw_cuda.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_cuda.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod base_hooks.mod kinds.mod fft_tools.mod message_passing.mod fast.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pw_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod base_hooks.mod kinds.mod cp_log_handling.mod kahan_sum.mod fft_tools.mod pw_fpga.mod machine.mod fast.mod message_passing.mod pw_cuda.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_methods.F pw_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:34:40 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_methods.F:1837:30: 1837 | pw2%in_space = out_space | ^ Warning: ‘out_space’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_methods.F:2102:57: 2102 | integral_value = integral_value*pw1%pw_grid%dvol | ^ Warning: ‘integral_value’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_methods.F:2051:56: 2051 | integral_value = integral_value*pw1%pw_grid%vol | ^ Warning: ‘integral_value’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pw_methods.mod' due to: pw_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod base_hooks.mod kinds.mod cp_log_handling.mod kahan_sum.mod fft_tools.mod pw_fpga.mod machine.mod fast.mod message_passing.mod pw_cuda.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'realspace_grid_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/realspace_grid_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod base_hooks.mod kinds.mod cp_log_handling.mod mathlib.mod kahan_sum.mod cp_array_utils.mod util.mod machine.mod pw_methods.mod fast.mod message_passing.mod pw_grids.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/realspace_grid_types.F realspace_grid_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:34:48 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/realspace_grid_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' realspace_grid_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'realspace_grid_types.mod' due to: realspace_grid_types.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/realspace_grid_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod base_hooks.mod kinds.mod cp_log_handling.mod mathlib.mod kahan_sum.mod cp_array_utils.mod util.mod machine.mod pw_methods.mod fast.mod message_passing.mod pw_grids.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_units.mod' due to: cp_units.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cell_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/subsys/cell_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod mathlib.mod mathconstants.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/subsys/cell_types.F cell_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:34:58 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/cell_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/subsys/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cell_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cell_types.mod' due to: cell_types.o /build/cp2k-Q381vr/cp2k-8.1/src/subsys/cell_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod mathlib.mod mathconstants.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cube_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/cube_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod base_hooks.mod kinds.mod mathlib.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/cube_utils.F cube_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:34:59 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/cube_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cube_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cube_utils.mod' due to: cube_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/cube_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod base_hooks.mod kinds.mod mathlib.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'grid_api.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_api.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod cell_types.mod base_hooks.mod kinds.mod cube_utils.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_api.F grid_api.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:00 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"grid/grid_api.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/grid/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' grid_api.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'grid_replay.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_replay.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_collocate.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_integrate.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_cpu_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/hybrid/grid_hybrid_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_replay.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/gpu/grid_gpu_task_list.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_replay.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'grid_task_list.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_task_list.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_library.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_cpu_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/hybrid/grid_hybrid_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/gpu/grid_gpu_task_list.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_task_list.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgrid.a' due to: grid_api.o grid_replay.o grid_task_list.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgrid.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgrid.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgrid.a grid_api.o grid_replay.o grid_task_list.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgrid.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'grid_collocate_hybrid.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grid/hybrid/grid_collocate_hybrid.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/collocation_integration.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_library.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_prepare_pab_dgemm.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/coefficients.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_context_cpu.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/tensor_local.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/grid/hybrid/grid_collocate_hybrid.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'grid_integrate_hybrid.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grid/hybrid/grid_integrate_hybrid.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/collocation_integration.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_library.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_prepare_pab_dgemm.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/coefficients.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/hybrid/grid_hybrid_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_context_cpu.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/tensor_local.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/grid/hybrid/grid_integrate_hybrid.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridhybrid.a' due to: grid_collocate_hybrid.o grid_integrate_hybrid.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridhybrid.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridhybrid.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridhybrid.a grid_collocate_hybrid.o grid_integrate_hybrid.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridhybrid.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'grid_prepare_pab_dgemm.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_prepare_pab_dgemm.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_prepare_pab_dgemm.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/tensor_local.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_prepare_pab_dgemm.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'non_orthorombic_corrections.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/non_orthorombic_corrections.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/non_orthorombic_corrections.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/tensor_local.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/non_orthorombic_corrections.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'grid_integrate_dgemm.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_integrate_dgemm.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/collocation_integration.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_collocate_dgemm.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/coefficients.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/non_orthorombic_corrections.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/tensor_local.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_integrate_dgemm.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'grid_context_cpu.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_context_cpu.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/collocation_integration.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/tensor_local.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_collocate_dgemm.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_library.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_cpu_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_context_cpu.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_context_cpu.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'coefficients.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/coefficients.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/coefficients.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/tensor_local.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/coefficients.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/tensor_local.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'grid_collocate_dgemm.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_collocate_dgemm.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/collocation_integration.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_collocate_dgemm.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_cpu_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_prepare_pab_dgemm.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/coefficients.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/non_orthorombic_corrections.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/tensor_local.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_collocate_dgemm.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'tensor_local.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/tensor_local.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/tensor_local.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/tensor_local.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'collocation_integration.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/collocation_integration.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/collocation_integration.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/tensor_local.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/non_orthorombic_corrections.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/collocation_integration.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcpu.a' due to: grid_prepare_pab_dgemm.o non_orthorombic_corrections.o grid_integrate_dgemm.o grid_context_cpu.o coefficients.o utils.o grid_collocate_dgemm.o tensor_local.o collocation_integration.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcpu.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcpu.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcpu.a grid_prepare_pab_dgemm.o non_orthorombic_corrections.o grid_integrate_dgemm.o grid_context_cpu.o coefficients.o utils.o grid_collocate_dgemm.o tensor_local.o collocation_integration.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcpu.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'grid_ref_prepare_pab.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_prepare_pab.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_prepare_pab.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_prepare_pab.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_prepare_pab.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'grid_ref_task_list.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_task_list.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_collocate.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_integrate.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_task_list.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'grid_ref_integrate.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_integrate.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_integrate.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_library.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_collint.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_integrate.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'grid_ref_collocate.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_collocate.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_collocate.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_integrate.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_library.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_prepare_pab.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_collint.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_collocate.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridref.a' due to: grid_ref_prepare_pab.o grid_ref_task_list.o grid_ref_integrate.o grid_ref_collocate.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridref.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridref.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridref.a grid_ref_prepare_pab.o grid_ref_task_list.o grid_ref_integrate.o grid_ref_collocate.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridref.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'grid_basis_set.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'grid_buffer.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'grid_sphere_cache.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_sphere_cache.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_library.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_sphere_cache.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_sphere_cache.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'grid_library.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_library.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_library.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_sphere_cache.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_library.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcommon.a' due to: grid_basis_set.o grid_buffer.o grid_sphere_cache.o grid_library.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcommon.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcommon.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcommon.a grid_basis_set.o grid_buffer.o grid_sphere_cache.o grid_library.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcommon.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'shell_potential_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/subsys/shell_potential_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/subsys/shell_potential_types.F shell_potential_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:21 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/shell_potential_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/subsys/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' shell_potential_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'damping_dipole_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/subsys/damping_dipole_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/subsys/damping_dipole_types.F damping_dipole_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:21 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/damping_dipole_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/subsys/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' damping_dipole_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'atprop_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/subsys/atprop_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/subsys/atprop_types.F atprop_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:21 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/atprop_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/subsys/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atprop_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_parser_ilist_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_ilist_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_ilist_types.F cp_parser_ilist_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:22 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_parser_ilist_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/input/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_parser_ilist_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_parser_ilist_types.mod' due to: cp_parser_ilist_types.o /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_ilist_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_parser_buffer_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_buffer_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_buffer_types.F cp_parser_buffer_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:22 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_parser_buffer_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/input/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_parser_buffer_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_parser_buffer_types.mod' due to: cp_parser_buffer_types.o /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_buffer_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_parser_status_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_status_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_parser_buffer_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_status_types.F cp_parser_status_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_parser_status_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/input/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_parser_status_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_parser_status_types.mod' due to: cp_parser_status_types.o /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_status_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_parser_buffer_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_parser_inpp_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_inpp_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_inpp_types.F cp_parser_inpp_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_parser_inpp_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/input/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_parser_inpp_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_parser_inpp_types.mod' due to: cp_parser_inpp_types.o /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_inpp_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_parser_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_ilist_types.mod cp_parser_status_types.mod cp_parser_inpp_types.mod cp_parser_buffer_types.mod cp_para_env.mod base_hooks.mod kinds.mod string_utilities.mod message_passing.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_types.F cp_parser_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_parser_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/input/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_parser_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_types.F:110:27: 110 | SUBROUTINE parser_retain(parser) | ^ Warning: ‘parser_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_parser_types.mod' due to: cp_parser_types.o /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_ilist_types.mod cp_parser_status_types.mod cp_parser_inpp_types.mod cp_parser_buffer_types.mod cp_para_env.mod base_hooks.mod kinds.mod string_utilities.mod message_passing.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_enumeration_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input/input_enumeration_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod cp_log_handling.mod string_utilities.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input/input_enumeration_types.F input_enumeration_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:24 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/input_enumeration_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/input/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_enumeration_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_enumeration_types.mod' due to: input_enumeration_types.o /build/cp2k-Q381vr/cp2k-8.1/src/input/input_enumeration_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod cp_log_handling.mod string_utilities.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_val_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input/input_val_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_enumeration_types.mod cp_parser_types.mod base_hooks.mod kinds.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input/input_val_types.F input_val_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:25 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/input_val_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/input/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_val_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_val_types.mod' due to: input_val_types.o /build/cp2k-Q381vr/cp2k-8.1/src/input/input_val_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_enumeration_types.mod cp_parser_types.mod base_hooks.mod kinds.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_keyword_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input/input_keyword_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_enumeration_types.mod input_val_types.mod base_hooks.mod kinds.mod string_utilities.mod reference_manager.mod print_messages.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input/input_keyword_types.F input_keyword_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/input_keyword_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/input/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_keyword_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/input/input_keyword_types.F:542:83: 542 | c_string = cp_unit_desc(keyword%unit, accept_undefined=.TRUE.) | 1 Warning: CHARACTER expression will be truncated in assignment (80/120) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_keyword_types.mod' due to: input_keyword_types.o /build/cp2k-Q381vr/cp2k-8.1/src/input/input_keyword_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_enumeration_types.mod input_val_types.mod base_hooks.mod kinds.mod string_utilities.mod reference_manager.mod print_messages.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_linked_list_input.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_linked_list_input.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_linked_list.fypp input_val_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_linked_list_input.F cp_linked_list_input.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:31 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_linked_list_input.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/input/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_linked_list_input.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_linked_list_input.mod' due to: cp_linked_list_input.o /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_linked_list_input.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_linked_list.fypp input_val_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_section_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input/input_section_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_val_types.mod base_hooks.mod kinds.mod cp_log_handling.mod string_utilities.mod cp_linked_list_input.mod reference_manager.mod print_messages.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input/input_section_types.F input_section_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:33 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/input_section_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/input/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_section_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/input/input_section_types.F:904:3: 904 | FUNCTION section_get_cval(section_vals, keyword_name) RESULT(res) | ^ Warning: ‘section_get_cval’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/input/input_section_types.F:936:3: 936 | FUNCTION section_get_rvals(section_vals, keyword_name) RESULT(res) | ^ Warning: ‘section_get_rvals’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_section_types.mod' due to: input_section_types.o /build/cp2k-Q381vr/cp2k-8.1/src/input/input_section_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_val_types.mod base_hooks.mod kinds.mod cp_log_handling.mod string_utilities.mod cp_linked_list_input.mod reference_manager.mod print_messages.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'bibliography.mod' due to: bibliography.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'orbital_symbols.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/orbital_symbols.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/orbital_symbols.F orbital_symbols.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:37 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/orbital_symbols.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' orbital_symbols.F90 /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/orbital_symbols.F:126:31: 126 | symbol(i:i) = l_sym(l) | ^ Warning: ‘i’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'orbital_symbols.mod' due to: orbital_symbols.o /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/orbital_symbols.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'orbital_pointers.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/orbital_pointers.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/orbital_pointers.F orbital_pointers.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:37 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/orbital_pointers.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' orbital_pointers.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'orbital_pointers.mod' due to: orbital_pointers.o /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/orbital_pointers.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'orbital_transformation_matrices.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/orbital_transformation_matrices.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod mathlib.mod orbital_symbols.mod mathconstants.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/orbital_transformation_matrices.F orbital_transformation_matrices.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:39 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/orbital_transformation_matrices.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' orbital_transformation_matrices.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'orbital_transformation_matrices.mod' due to: orbital_transformation_matrices.o /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/orbital_transformation_matrices.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod mathlib.mod orbital_symbols.mod mathconstants.mod orbital_pointers.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'periodic_table.mod' due to: periodic_table.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ao_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ao_util.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod mathconstants.mod orbital_transformation_matrices.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ao_util.F ao_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:41 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ao_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ao_util.F90 /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ao_util.F:472:27: 472 | SUBROUTINE transform_c2s(CPC_co, CPC_so, maxl, lm1, lm2) | ^ Warning: ‘transform_c2s’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ao_util.F:567:31: 567 | SUBROUTINE transform_c2s_new(CPC_co, CPC_so, maxl) | ^ Warning: ‘transform_c2s_new’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ao_util.F:602:27: 602 | SUBROUTINE transform_s2c(matso, matco, maxl, lm1, lm2) | ^ Warning: ‘transform_s2c’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ao_util.F:676:26: 676 | SUBROUTINE sph2cart_mat(mat, ld_mat, sd_mat, n, lmax1, lmax2) | ^ Warning: ‘sph2cart_mat’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ao_util.F:206:10: 206 | IF (g(1) .LT. t) RETURN ! early exit | ^ Warning: ‘t’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ao_util.F:197:49: 197 | r = MAX(SQRT(0.5_dp*REAL(l, dp)/a), radius) | ^ Warning: ‘a’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ao_util.mod' due to: ao_util.o /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ao_util.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod mathconstants.mod orbital_transformation_matrices.mod orbital_pointers.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_parser_ilist_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_ilist_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_parser_ilist_types.mod base_hooks.mod cp_log_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_ilist_methods.F cp_parser_ilist_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:42 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_parser_ilist_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/input/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_parser_ilist_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_parser_ilist_methods.mod' due to: cp_parser_ilist_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_ilist_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_parser_ilist_types.mod base_hooks.mod cp_log_handling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_parser_inpp_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_inpp_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_parser_inpp_types.mod base_hooks.mod cp_log_handling.mod kinds.mod memory_utilities.mod string_utilities.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_inpp_methods.F cp_parser_inpp_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:42 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_parser_inpp_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/input/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_parser_inpp_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_inpp_methods.F:237:53: 237 | filename = "xc_section"//'/'//filename | 1 Warning: CHARACTER expression will be truncated in assignment (1024/1035) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_inpp_methods.F:605:75: 605 | newline = input_line(1:pos1 - 3)//var_value//input_line(pos2 + 2:) | ^ Warning: ‘.var_value’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_parser_inpp_methods.mod' due to: cp_parser_inpp_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_inpp_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_parser_inpp_types.mod base_hooks.mod cp_log_handling.mod kinds.mod memory_utilities.mod string_utilities.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_parser_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_types.mod cp_parser_buffer_types.mod base_hooks.mod cp_parser_ilist_methods.mod cp_log_handling.mod kinds.mod string_utilities.mod cp_parser_inpp_methods.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_methods.F cp_parser_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:44 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_parser_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/input/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_parser_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_methods.F:1400:33: 1400 | object8 = object8*iz8 | ^ Warning: ‘object8’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_methods.F:571:68: 571 | length = MIN(len_trim_inputline - parser%icol1 + 1, length) | ^ Warning: ‘length’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_parser_methods.mod' due to: cp_parser_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_parser_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_types.mod cp_parser_buffer_types.mod base_hooks.mod cp_parser_ilist_methods.mod cp_log_handling.mod kinds.mod string_utilities.mod cp_parser_inpp_methods.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'external_potential_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/subsys/external_potential_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_types.mod input_val_types.mod input_section_types.mod base_hooks.mod kinds.mod mathlib.mod mathconstants.mod memory_utilities.mod bibliography.mod orbital_transformation_matrices.mod string_utilities.mod cp_linked_list_input.mod orbital_pointers.mod periodic_table.mod ao_util.mod cp_parser_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/subsys/external_potential_types.F external_potential_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:46 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/external_potential_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/subsys/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' external_potential_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/subsys/external_potential_types.F:2339:120: 2339 | WRITE (line_att, '(A)') " # Potential name: "//apname2(:strlen2)//" for symbol: "//symbol2(:strlen1) | ^ Warning: ‘strlen2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/external_potential_types.F:2339:120: Warning: ‘strlen1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/external_potential_types.F:1711:120: 1711 | WRITE (line_att, '(A)') " # Potential name: "//apname2(:strlen2)//" for symbol: "//symbol2(:strlen1) | ^ Warning: ‘strlen2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/external_potential_types.F:1711:120: Warning: ‘strlen1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/external_potential_types.F:1532:120: 1532 | WRITE (line_att, '(A)') " # Potential name: "//apname2(:strlen2)//" for symbol: "//symbol2(:strlen1) | ^ Warning: ‘strlen2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/external_potential_types.F:1532:120: Warning: ‘strlen1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'damping_dipole_types.mod' due to: damping_dipole_types.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'shell_potential_types.mod' due to: shell_potential_types.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'external_potential_types.mod' due to: external_potential_types.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'atomic_kind_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/subsys/atomic_kind_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 damping_dipole_types.mod shell_potential_types.mod external_potential_types.mod base_hooks.mod kinds.mod periodic_table.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/subsys/atomic_kind_types.F atomic_kind_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:56 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/atomic_kind_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/subsys/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atomic_kind_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'atomic_kind_types.mod' due to: atomic_kind_types.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'particle_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/subsys/particle_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod base_hooks.mod message_passing.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/subsys/particle_types.F particle_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:57 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/particle_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/subsys/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' particle_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'particle_types.mod' due to: particle_types.o /build/cp2k-Q381vr/cp2k-8.1/src/subsys/particle_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod base_hooks.mod message_passing.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'colvar_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/subsys/colvar_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod input_section_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/subsys/colvar_types.F colvar_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:35:57 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/colvar_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/subsys/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' colvar_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/subsys/colvar_types.F:1036:82: 1036 | INTEGER, DIMENSION(:), POINTER :: i_hydrogens, i_oxygens | ^ Warning: ‘i_oxygens.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/colvar_types.F:1036:82: Warning: ‘i_oxygens.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/colvar_types.F:1069:13: 1069 | IF (ANY(i_hydrogens == i)) & | ^ Warning: ‘i_hydrogens.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/colvar_types.F:1036:71: 1036 | INTEGER, DIMENSION(:), POINTER :: i_hydrogens, i_oxygens | ^ Warning: ‘i_hydrogens.dim[0].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/colvar_types.F:1036:71: Warning: ‘i_hydrogens.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/colvar_types.F:1036:71: Warning: ‘i_hydrogens.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/colvar_types.F:1083:19: 1083 | IF (i > n_oxygens) & | ^ Warning: ‘n_oxygens’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/colvar_types.F:1035:84: 1035 | INTEGER :: i, idum, ii, n_hydrogens, n_oxygens, np | ^ Warning: ‘n_hydrogens’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/colvar_types.F:1107:75: 1107 | i_oxygens_water | ^ Warning: ‘i_oxygens_water.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/colvar_types.F:1107:75: Warning: ‘i_oxygens_water.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/colvar_types.F:1150:13: 1150 | IF (ANY(i_oxygens_acid == i)) & | ^ Warning: ‘i_oxygens_acid.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/colvar_types.F:1106:87: 1106 | INTEGER, DIMENSION(:), POINTER :: i_hydrogens, i_oxygens_acid, & | ^ Warning: ‘i_oxygens_acid.dim[0].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/colvar_types.F:1106:87: Warning: ‘i_oxygens_acid.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/colvar_types.F:1106:87: Warning: ‘i_oxygens_acid.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/colvar_types.F:1157:13: 1157 | IF (ANY(i_hydrogens == i)) & | ^ Warning: ‘i_hydrogens.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/colvar_types.F:1106:71: 1106 | INTEGER, DIMENSION(:), POINTER :: i_hydrogens, i_oxygens_acid, & | ^ Warning: ‘i_hydrogens.dim[0].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/colvar_types.F:1106:71: Warning: ‘i_hydrogens.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/colvar_types.F:1106:71: Warning: ‘i_hydrogens.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/colvar_types.F:1104:84: 1104 | INTEGER :: i, idum, ii, n_hydrogens, & | ^ Warning: ‘n_hydrogens’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'colvar_types.mod' due to: colvar_types.o /build/cp2k-Q381vr/cp2k-8.1/src/subsys/colvar_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod input_section_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'force_field_kind_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/subsys/force_field_kind_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/subsys/force_field_kind_types.F force_field_kind_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:06 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/force_field_kind_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/subsys/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_field_kind_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'force_field_kind_types.mod' due to: force_field_kind_types.o /build/cp2k-Q381vr/cp2k-8.1/src/subsys/force_field_kind_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_output_handling.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_output_handling.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod cp_iter_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod memory_utilities.mod machine.mod string_utilities.mod message_passing.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_output_handling.F cp_output_handling.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:06 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_output_handling.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/input/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_output_handling.F90 /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_output_handling.F:731:23: 731 | outName = outPath | 1 Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_output_handling.mod' due to: cp_output_handling.o /build/cp2k-Q381vr/cp2k-8.1/src/input/cp_output_handling.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod cp_iter_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod memory_utilities.mod machine.mod string_utilities.mod message_passing.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'molecule_kind_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/subsys/molecule_kind_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod force_field_kind_types.mod shell_potential_types.mod atomic_kind_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_output_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/subsys/molecule_kind_types.F molecule_kind_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:08 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/molecule_kind_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/subsys/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molecule_kind_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'molecule_kind_types.mod' due to: molecule_kind_types.o /build/cp2k-Q381vr/cp2k-8.1/src/subsys/molecule_kind_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod force_field_kind_types.mod shell_potential_types.mod atomic_kind_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_output_handling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'molecule_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/subsys/molecule_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod colvar_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/subsys/molecule_types.F molecule_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:10 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/molecule_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/subsys/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molecule_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/subsys/molecule_types.F:502:94: 502 | INTEGER :: first_atom, iatom, imol, last_atom, & | ^ Warning: ‘last_atom’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/molecule_types.F:502:70: 502 | INTEGER :: first_atom, iatom, imol, last_atom, & | ^ Warning: ‘first_atom’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/molecule_types.F:467:94: 467 | INTEGER :: first_atom, iatom, imol, last_atom | ^ Warning: ‘last_atom’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/subsys/molecule_types.F:467:70: 467 | INTEGER :: first_atom, iatom, imol, last_atom | ^ Warning: ‘first_atom’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'molecule_types.mod' due to: molecule_types.o /build/cp2k-Q381vr/cp2k-8.1/src/subsys/molecule_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod colvar_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'molecule_list_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/subsys/molecule_list_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/subsys/subsys_list.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 molecule_types.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/subsys/molecule_list_types.F molecule_list_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:11 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/molecule_list_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/subsys/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molecule_list_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'atomic_kind_list_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/subsys/atomic_kind_list_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/subsys/subsys_list.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/subsys/atomic_kind_list_types.F atomic_kind_list_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:12 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/atomic_kind_list_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/subsys/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atomic_kind_list_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'multipole_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/subsys/multipole_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 external_potential_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/subsys/multipole_types.F multipole_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:12 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/multipole_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/subsys/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' multipole_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'molecule_kind_list_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/subsys/molecule_kind_list_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/subsys/subsys_list.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/subsys/molecule_kind_list_types.F molecule_kind_list_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:13 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/molecule_kind_list_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/subsys/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molecule_kind_list_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'molecule_kind_list_types.mod' due to: molecule_kind_list_types.o /build/cp2k-Q381vr/cp2k-8.1/src/subsys/molecule_kind_list_types.F /build/cp2k-Q381vr/cp2k-8.1/src/subsys/subsys_list.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'multipole_types.mod' due to: multipole_types.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'virial_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/subsys/virial_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/subsys/virial_types.F virial_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:14 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/virial_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/subsys/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' virial_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'virial_types.mod' due to: virial_types.o /build/cp2k-Q381vr/cp2k-8.1/src/subsys/virial_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'atomic_kind_list_types.mod' due to: atomic_kind_list_types.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'atprop_types.mod' due to: atprop_types.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'molecule_list_types.mod' due to: molecule_list_types.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'distribution_1d_types.mod' due to: distribution_1d_types.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'particle_list_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/subsys/particle_list_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/subsys/subsys_list.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/subsys/particle_list_types.F particle_list_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:15 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/particle_list_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/subsys/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' particle_list_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'particle_list_types.mod' due to: particle_list_types.o /build/cp2k-Q381vr/cp2k-8.1/src/subsys/particle_list_types.F /build/cp2k-Q381vr/cp2k-8.1/src/subsys/subsys_list.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_subsys_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/subsys/cp_subsys_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod molecule_kind_list_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod multipole_types.mod cp_result_types.mod virial_types.mod atomic_kind_list_types.mod atprop_types.mod particle_types.mod molecule_types.mod molecule_list_types.mod cp_para_types.mod distribution_1d_types.mod particle_list_types.mod kinds.mod cp_para_env.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/subsys/cp_subsys_types.F cp_subsys_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:15 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/cp_subsys_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/subsys/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_subsys_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ksubsys.a' due to: shell_potential_types.o damping_dipole_types.o atprop_types.o external_potential_types.o atomic_kind_types.o molecule_list_types.o colvar_types.o molecule_types.o atomic_kind_list_types.o multipole_types.o cp_subsys_types.o particle_types.o particle_list_types.o molecule_kind_list_types.o force_field_kind_types.o molecule_kind_types.o cell_types.o virial_types.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ksubsys.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ksubsys.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ksubsys.a shell_potential_types.o damping_dipole_types.o atprop_types.o external_potential_types.o atomic_kind_types.o molecule_list_types.o colvar_types.o molecule_types.o atomic_kind_list_types.o multipole_types.o cp_subsys_types.o particle_types.o particle_list_types.o molecule_kind_list_types.o force_field_kind_types.o molecule_kind_types.o cell_types.o virial_types.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ksubsys.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_blacs_calls.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_blacs_calls.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_blacs_calls.F cp_blacs_calls.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:17 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_blacs_calls.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/fm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_blacs_calls.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_blacs_calls.mod' due to: cp_blacs_calls.o /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_blacs_calls.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_blacs_env.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_blacs_env.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_para_env.mod cp_blacs_calls.mod base_hooks.mod kinds.mod mathlib.mod cp_array_utils.mod machine.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_blacs_env.F cp_blacs_env.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:17 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_blacs_env.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/fm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_blacs_env.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_blacs_env.mod' due to: cp_blacs_env.o /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_blacs_env.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_para_env.mod cp_blacs_calls.mod base_hooks.mod kinds.mod mathlib.mod cp_array_utils.mod machine.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_fm_struct.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_struct.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_para_env.mod base_hooks.mod kinds.mod cp_log_handling.mod cp_blacs_env.mod machine.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_struct.F cp_fm_struct.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:18 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_struct.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/fm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_struct.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_fm_struct.mod' due to: cp_fm_struct.o /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_struct.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_para_env.mod base_hooks.mod kinds.mod cp_log_handling.mod cp_blacs_env.mod machine.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_fm_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod base_hooks.mod cp_blacs_calls.mod cp_log_handling.mod kinds.mod cp_fm_struct.mod cp_blacs_env.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_types.F cp_fm_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:19 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/fm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_types.F:1894:40: 1894 | SUBROUTINE cp_fm_to_fm_submat_general(source, & | ^ Warning: ‘cp_fm_to_fm_submat_general’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_types.F:1138:10: 1138 | IF (docol) THEN | ^ Warning: ‘docol’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_types.F:977:57: 977 | ir_max_vec(mepos) = row_indices(ir_max_local) | ^ Warning: ‘ir_max_local’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_types.F:978:57: 978 | ic_max_vec(mepos) = col_indices(ic_max_local) | ^ Warning: ‘ic_max_local’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_fm_types.mod' due to: cp_fm_types.o /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod base_hooks.mod cp_blacs_calls.mod cp_log_handling.mod kinds.mod cp_fm_struct.mod cp_blacs_env.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_fm_cholesky.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_cholesky.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_blacs_env.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_cholesky.F cp_fm_cholesky.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:25 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_cholesky.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/fm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_cholesky.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_linked_list_fm.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_linked_list_fm.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_linked_list.fypp cp_fm_types.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_linked_list_fm.F cp_linked_list_fm.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:25 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_linked_list_fm.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/fm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_linked_list_fm.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_linked_list_fm.mod' due to: cp_linked_list_fm.o /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_linked_list_fm.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_linked_list.fypp cp_fm_types.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_fm_pool_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_pool_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod cp_linked_list_fm.mod base_hooks.mod cp_log_handling.mod cp_fm_struct.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_pool_types.F cp_fm_pool_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_pool_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/fm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_pool_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_pool_types.F:259:27: 259 | SUBROUTINE fm_pools_copy(source_pools, target_pools) | ^ Warning: ‘fm_pools_copy’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_fm_diag_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_diag_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_types.mod cp_para_env.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod cp_fm_struct.mod cp_blacs_env.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_diag_utils.F cp_fm_diag_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_diag_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/fm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_diag_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_fm_vect.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_vect.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_vect.F cp_fm_vect.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_vect.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/fm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_vect.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_fm_basic_linalg.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_basic_linalg.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod kahan_sum.mod cp_fm_struct.mod cp_blacs_env.mod machine.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_basic_linalg.F cp_fm_basic_linalg.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:28 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_basic_linalg.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/fm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_basic_linalg.F90 /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_basic_linalg.F:196:25: 196 | SUBROUTINE cp_fm_geadd(alpha, trans, matrix_a, beta, matrix_b) | ^ Warning: ‘cp_fm_geadd’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_basic_linalg.F:277:32: 277 | SUBROUTINE cp_fm_lu_decompose(matrix_a, almost_determinant, correct_sign) | ^ Warning: ‘cp_fm_lu_decompose’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_basic_linalg.F:1892:29: 1892 | SUBROUTINE cp_fm_lu_invert(matrix, info_out) | ^ Warning: ‘cp_fm_lu_invert’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_basic_linalg.F:2111:3: 2111 | FUNCTION cp_fm_latra(matrix) RESULT(res) | ^ Warning: ‘cp_fm_latra’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_basic_linalg.F:2065:34: 2065 | ALLOCATE (work_sp(lwork)) | ^ Warning: ‘lwork’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_basic_linalg.F:1625:45: 1625 | IF (PRESENT(det_a)) det_a = determinant | ^ Warning: ‘determinant’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_fm_basic_linalg.mod' due to: cp_fm_basic_linalg.o /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_basic_linalg.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod kahan_sum.mod cp_fm_struct.mod cp_blacs_env.mod machine.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_fm_diag_utils.mod' due to: cp_fm_diag_utils.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_fm_elpa.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_elpa.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_fm_struct.mod cp_blacs_env.mod machine.mod cp_fm_basic_linalg.mod message_passing.mod cp_fm_diag_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_elpa.F cp_fm_elpa.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:31 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_elpa.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/fm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_elpa.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_fm_elpa.mod' due to: cp_fm_elpa.o /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_elpa.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_fm_struct.mod cp_blacs_env.mod machine.mod cp_fm_basic_linalg.mod message_passing.mod cp_fm_diag_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_fm_cholesky.mod' due to: cp_fm_cholesky.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_fm_diag.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_diag.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_types.mod cp_para_env.mod cp_blacs_calls.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_fm_struct.mod cp_blacs_env.mod machine.mod cp_fm_basic_linalg.mod cp_fm_elpa.mod message_passing.mod cp_fm_cholesky.mod cp_fm_diag_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_diag.F cp_fm_diag.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:32 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_diag.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/fm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_diag.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_cfm_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_cfm_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_types.mod base_hooks.mod cp_blacs_calls.mod cp_log_handling.mod kinds.mod cp_fm_struct.mod mathconstants.mod cp_blacs_env.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_cfm_types.F cp_cfm_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:34 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_cfm_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/fm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_cfm_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_cfm_types.F:824:38: 824 | SUBROUTINE cp_cfm_to_cfm_triangular(msource, mtarget, uplo) | ^ Warning: ‘cp_cfm_to_cfm_triangular’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_cfm_types.mod' due to: cp_cfm_types.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_cfm_basic_linalg.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_cfm_basic_linalg.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_fm_types.mod base_hooks.mod kinds.mod kahan_sum.mod cp_fm_struct.mod mathconstants.mod cp_blacs_env.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_cfm_basic_linalg.F cp_cfm_basic_linalg.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:37 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_cfm_basic_linalg.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/fm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_cfm_basic_linalg.F90 /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_cfm_basic_linalg.F:107:37: 107 | SUBROUTINE cp_cfm_schur_product_cc(matrix_a, matrix_b, matrix_c) | ^ Warning: ‘cp_cfm_schur_product_cc’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_cfm_basic_linalg.F:1285:28: 1285 | ALLOCATE (work(lwork)) | ^ Warning: ‘lwork’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_cfm_basic_linalg.mod' due to: cp_cfm_basic_linalg.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_cfm_diag.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_cfm_diag.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod base_hooks.mod kinds.mod cp_cfm_basic_linalg.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_cfm_diag.F cp_cfm_diag.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:39 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_cfm_diag.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/fm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_cfm_diag.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfm.a' due to: cp_fm_cholesky.o cp_fm_pool_types.o cp_fm_struct.o cp_fm_diag_utils.o cp_fm_vect.o cp_blacs_calls.o cp_fm_diag.o cp_cfm_types.o cp_fm_elpa.o cp_linked_list_fm.o cp_cfm_basic_linalg.o cp_cfm_diag.o cp_blacs_env.o cp_fm_basic_linalg.o cp_fm_types.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfm.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfm.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfm.a cp_fm_cholesky.o cp_fm_pool_types.o cp_fm_struct.o cp_fm_diag_utils.o cp_fm_vect.o cp_blacs_calls.o cp_fm_diag.o cp_cfm_types.o cp_fm_elpa.o cp_linked_list_fm.o cp_cfm_basic_linalg.o cp_cfm_diag.o cp_blacs_env.o cp_fm_basic_linalg.o cp_fm_types.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfm.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'gamma.mod' due to: gamma.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 't_c_g0.mod' due to: t_c_g0.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ai_operators_r12.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_operators_r12.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod gamma.mod mathconstants.mod orbital_pointers.mod t_c_g0.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_operators_r12.F ai_operators_r12.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:40 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_operators_r12.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_operators_r12.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ai_coulomb.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_coulomb.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod gamma.mod mathconstants.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_coulomb.F ai_coulomb.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:42 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_coulomb.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_coulomb.F90 /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_coulomb.F:1565:85: 1565 | fcz*v(coset(ax, ay, az), 1, cocz, n + 1) | ^ Warning: ‘rbp[2]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_coulomb.F:1709:91: 1709 | coset(0, by - 1, bz), cocy, n + 1) | ^ Warning: ‘rbp[1]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_coulomb.F:1756:87: 1756 | coset(0, by, bz), cocx, n + 1) | ^ Warning: ‘rbp[0]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ai_coulomb.mod' due to: ai_coulomb.o /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_coulomb.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod gamma.mod mathconstants.mod orbital_pointers.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ai_coulomb_test.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_coulomb_test.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod machine.mod ai_coulomb.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_coulomb_test.F ai_coulomb_test.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_coulomb_test.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_coulomb_test.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ai_overlap_aabb.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap_aabb.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap_aabb.F ai_overlap_aabb.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:55 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_overlap_aabb.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_overlap_aabb.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'sto_ng.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/sto_ng.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/sto_ng.F sto_ng.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:36:58 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/sto_ng.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' sto_ng.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'sto_ng.mod' due to: sto_ng.o /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/sto_ng.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'basis_set_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/basis_set_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_types.mod input_val_types.mod input_section_types.mod base_hooks.mod kinds.mod orbital_symbols.mod util.mod mathconstants.mod memory_utilities.mod bibliography.mod orbital_transformation_matrices.mod ai_coulomb.mod sto_ng.mod string_utilities.mod cp_linked_list_input.mod orbital_pointers.mod cp_parser_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/basis_set_types.F basis_set_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:37:00 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/basis_set_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' basis_set_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/basis_set_types.F:507:37: 507 | bout%name = bout%name//bad%name | 1 Warning: CHARACTER expression will be truncated in assignment (80/160) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/basis_set_types.F:373:48: 373 | pbasis%name = basis_set%name//"_primitive" | 1 Warning: CHARACTER expression will be truncated in assignment (80/90) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/basis_set_types.F:2615:37: 2615 | ss = ss + sss*ca(i)*cb(j) | ^ Warning: ‘sss’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/basis_set_types.F:2391:63: 2391 | REAL(KIND=dp), DIMENSION(:), POINTER :: zet | ^ Warning: ‘zet.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/basis_set_types.F:2391:63: Warning: ‘zet.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/basis_set_types.F:2391:63: Warning: ‘zet.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/basis_set_types.F:2388:66: 2388 | INTEGER, DIMENSION(:), POINTER :: lq, nq | ^ Warning: ‘nq.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/basis_set_types.F:2388:66: Warning: ‘nq.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/basis_set_types.F:2388:66: Warning: ‘nq.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/basis_set_types.F:2388:62: 2388 | INTEGER, DIMENSION(:), POINTER :: lq, nq | ^ Warning: ‘lq.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/basis_set_types.F:2388:62: Warning: ‘lq.dim[0].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/basis_set_types.F:2388:62: Warning: ‘lq.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/basis_set_types.F:2388:62: Warning: ‘lq.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/basis_set_types.F:2388:62: Warning: ‘lq.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/basis_set_types.F:2412:31: 2412 | gto_basis_set%nset = nset | ^ Warning: ‘nshell’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'basis_set_types.mod' due to: basis_set_types.o /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/basis_set_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_types.mod input_val_types.mod input_section_types.mod base_hooks.mod kinds.mod orbital_symbols.mod util.mod mathconstants.mod memory_utilities.mod bibliography.mod orbital_transformation_matrices.mod ai_coulomb.mod sto_ng.mod string_utilities.mod cp_linked_list_input.mod orbital_pointers.mod cp_parser_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'basis_set_container_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/basis_set_container_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/basis_set_container_types.F basis_set_container_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:37:18 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/basis_set_container_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' basis_set_container_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/basis_set_container_types.F:198:38: 198 | DO i = ibas + 1, SIZE(container) | ^ Warning: ‘ibas’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ai_os_rr.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_os_rr.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 gamma.mod kinds.mod orbital_pointers.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_os_rr.F ai_os_rr.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:37:19 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_os_rr.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_os_rr.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ai_os_rr.mod' due to: ai_os_rr.o /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_os_rr.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 gamma.mod kinds.mod orbital_pointers.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ai_elec_field.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_elec_field.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod ai_os_rr.mod mathconstants.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_elec_field.F ai_elec_field.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:37:22 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_elec_field.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_elec_field.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ai_overlap.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod ai_os_rr.mod mathconstants.mod orbital_transformation_matrices.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap.F ai_overlap.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:37:24 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_overlap.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_overlap.F90 /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap.F:1364:26: 1364 | SUBROUTINE overlap_aaab(la1_max, la1_min, npgfa1, rpgfa1, zeta1, & | ^ Warning: ‘overlap_aaab’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap.F:1568:26: 1568 | SUBROUTINE overlap_aabb(la1_max, la1_min, npgfa1, rpgfa1, zeta1, & | ^ Warning: ‘overlap_aabb’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap.F:1776:26: 1776 | SUBROUTINE overlap_abbb(la_max, la_min, npgfa, rpgfa, zeta, & | ^ Warning: ‘overlap_abbb’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ai_verfc.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_verfc.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod gamma.mod mathconstants.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_verfc.F ai_verfc.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:37:32 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_verfc.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_verfc.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ai_overlap3_debug.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap3_debug.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap3_debug.F ai_overlap3_debug.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:37:38 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_overlap3_debug.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_overlap3_debug.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ai_derivatives.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_derivatives.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_derivatives.F ai_derivatives.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:37:38 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_derivatives.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_derivatives.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ai_overlap3.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap3.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap3.F ai_overlap3.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:37:40 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_overlap3.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_overlap3.F90 /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap3.F:135:68: 135 | REAL(KIND=dp), DIMENSION(:, :, :, :), POINTER :: sda, sdc | ^ Warning: ‘sdc.dim[3].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap3.F:135:68: Warning: ‘sdc.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap3.F:135:68: Warning: ‘sdc.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap3.F:135:68: Warning: ‘sdc.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap3.F:1150:85: 1150 | fax*s(coamx, cob, coc) | ^ Warning: ‘sda.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap3.F:135:63: 135 | REAL(KIND=dp), DIMENSION(:, :, :, :), POINTER :: sda, sdc | ^ note: ‘sda.offset’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap3.F:1150:85: 1150 | fax*s(coamx, cob, coc) | ^ Warning: ‘sda.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap3.F:135:63: 135 | REAL(KIND=dp), DIMENSION(:, :, :, :), POINTER :: sda, sdc | ^ note: ‘sda.dim[2].stride’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap3.F:1150:85: 1150 | fax*s(coamx, cob, coc) | ^ Warning: ‘sda.dim[3].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap3.F:135:63: 135 | REAL(KIND=dp), DIMENSION(:, :, :, :), POINTER :: sda, sdc | ^ note: ‘sda.dim[3].stride’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap3.F:135:63: Warning: ‘sda.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ai_contraction_sphi.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_contraction_sphi.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_contraction_sphi.F ai_contraction_sphi.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:37:48 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_contraction_sphi.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_contraction_sphi.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ai_derivatives.mod' due to: ai_derivatives.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ai_overlap.mod' due to: ai_overlap.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ai_moments.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_moments.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod mathconstants.mod ai_derivatives.mod orbital_pointers.mod ai_overlap.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_moments.F ai_moments.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:37:52 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_moments.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_moments.F90 /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_moments.F:883:46: 883 | s(1, 1, l) = rpc(i)*s(1, 1, l1) | ^ Warning: ‘l1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_moments.F:883:46: Warning: ‘i’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ai_eri_debug.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_eri_debug.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 gamma.mod mathconstants.mod kinds.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_eri_debug.F ai_eri_debug.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:01 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_eri_debug.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_eri_debug.F90 /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_eri_debug.F:56:21: 56 | SUBROUTINE init_os(ya, yb, yc, yd, rA, rB, rC, rD) | ^ Warning: ‘init_os’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'soft_basis_set.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/soft_basis_set.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod base_hooks.mod kinds.mod orbital_symbols.mod memory_utilities.mod orbital_pointers.mod ao_util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/soft_basis_set.F soft_basis_set.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:01 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/soft_basis_set.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' soft_basis_set.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ai_angmom.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_angmom.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_angmom.F ai_angmom.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:03 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_angmom.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_angmom.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ai_kinetic.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_kinetic.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod ai_os_rr.mod mathconstants.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_kinetic.F ai_kinetic.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:09 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_kinetic.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_kinetic.F90 /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_kinetic.F:73:77: 73 | ib, idx, idy, idz, ipgf, jpgf, la, lb, & | ^ Warning: ‘idz’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_kinetic.F:73:72: 73 | ib, idx, idy, idz, ipgf, jpgf, la, lb, & | ^ Warning: ‘idy’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_kinetic.F:73:67: 73 | ib, idx, idy, idz, ipgf, jpgf, la, lb, & | ^ Warning: ‘idx’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ai_overlap_debug.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap_debug.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap_debug.F ai_overlap_debug.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:10 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_overlap_debug.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_overlap_debug.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ai_oneelectron.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_oneelectron.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_oneelectron.F ai_oneelectron.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:10 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_oneelectron.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_oneelectron.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ai_oneelectron.mod' due to: ai_oneelectron.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ai_overlap_debug.mod' due to: ai_overlap_debug.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ai_overlap_ppl.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap_ppl.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod mathconstants.mod orbital_pointers.mod ai_oneelectron.mod ai_overlap_debug.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_overlap_ppl.F ai_overlap_ppl.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:15 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_overlap_ppl.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_overlap_ppl.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'aux_basis_set.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/aux_basis_set.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod base_hooks.mod kinds.mod orbital_symbols.mod lapack.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/aux_basis_set.F aux_basis_set.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:16 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/aux_basis_set.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' aux_basis_set.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ai_fermi_contact.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_fermi_contact.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_fermi_contact.F ai_fermi_contact.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:18 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_fermi_contact.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_fermi_contact.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ai_spin_orbit.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_spin_orbit.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod ai_os_rr.mod mathconstants.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_spin_orbit.F ai_spin_orbit.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:18 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_spin_orbit.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_spin_orbit.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ai_onecenter.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_onecenter.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_onecenter.F ai_onecenter.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:19 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_onecenter.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_onecenter.F90 /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_onecenter.F:798:22: 798 | SUBROUTINE sto_conf(gmat, rc, k, na, pa, nb, pb) | ^ Warning: ‘sto_conf’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_onecenter.F:870:25: 870 | SUBROUTINE num_overlap(smat, ra, rb, wr) | ^ Warning: ‘num_overlap’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_onecenter.F:907:25: 907 | SUBROUTINE num_kinetic(kmat, l, ra, dra, rb, drb, r, wr) | ^ Warning: ‘num_kinetic’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_onecenter.F:943:25: 943 | SUBROUTINE num_nuclear(umat, ra, rb, r, wr) | ^ Warning: ‘num_nuclear’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_onecenter.F:980:24: 980 | SUBROUTINE num_kinnuc(umat, l, ra, dra, rb, drb, r, wr) | ^ Warning: ‘num_kinnuc’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_onecenter.F:1017:21: 1017 | SUBROUTINE num_erf(upmat, a, ra, rb, r, wr) | ^ Warning: ‘num_erf’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_onecenter.F:1062:25: 1062 | SUBROUTINE num_proj_ol(spmat, l, ra, k, rc, r, wr) | ^ Warning: ‘num_proj_ol’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_onecenter.F:1110:22: 1110 | SUBROUTINE num_gpot(vpmat, k, rc, ra, rb, r, wr) | ^ Warning: ‘num_gpot’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_onecenter.F:1156:22: 1156 | SUBROUTINE num_conf(gmat, rc, k, ra, rb, r, wr) | ^ Warning: ‘num_conf’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ai_contraction.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_contraction.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_contraction.F ai_contraction.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:21 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_contraction.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_contraction.F90 /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_contraction.F:84:88: 84 | INTEGER :: lda, ldb, ldq, lds, ldw, mal, mbl, nal, & | ^ Warning: ‘mal’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ai_operator_ra2m.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_operator_ra2m.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod ai_os_rr.mod mathconstants.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_operator_ra2m.F ai_operator_ra2m.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:24 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_operator_ra2m.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/aobasis/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_operator_ra2m.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kao.a' due to: ai_operators_r12.o ai_coulomb_test.o ai_overlap_aabb.o basis_set_container_types.o ai_elec_field.o ai_overlap.o ai_os_rr.o ai_verfc.o ai_overlap3_debug.o sto_ng.o ao_util.o ai_derivatives.o ai_overlap3.o ai_contraction_sphi.o orbital_symbols.o ai_moments.o ai_coulomb.o ai_eri_debug.o soft_basis_set.o ai_angmom.o ai_kinetic.o ai_overlap_debug.o ai_oneelectron.o orbital_pointers.o ai_overlap_ppl.o basis_set_types.o orbital_transformation_matrices.o aux_basis_set.o ai_fermi_contact.o ai_spin_orbit.o ai_onecenter.o ai_contraction.o ai_operator_ra2m.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kao.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kao.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kao.a ai_operators_r12.o ai_coulomb_test.o ai_overlap_aabb.o basis_set_container_types.o ai_elec_field.o ai_overlap.o ai_os_rr.o ai_verfc.o ai_overlap3_debug.o sto_ng.o ao_util.o ai_derivatives.o ai_overlap3.o ai_contraction_sphi.o orbital_symbols.o ai_moments.o ai_coulomb.o ai_eri_debug.o soft_basis_set.o ai_angmom.o ai_kinetic.o ai_overlap_debug.o ai_oneelectron.o orbital_pointers.o ai_overlap_ppl.o basis_set_types.o orbital_transformation_matrices.o aux_basis_set.o ai_fermi_contact.o ai_spin_orbit.o ai_onecenter.o ai_contraction.o ai_operator_ra2m.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kao.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_parsing.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input/input_parsing.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_enumeration_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_parser_methods.mod string_utilities.mod cp_linked_list_input.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input/input_parsing.F input_parsing.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:25 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/input_parsing.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/input/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_parsing.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kinput.a' due to: cp_parser_buffer_types.o cp_parser_methods.o input_enumeration_types.o cp_parser_status_types.o input_parsing.o cp_output_handling.o cp_parser_inpp_types.o input_val_types.o cp_linked_list_input.o cp_parser_inpp_methods.o input_section_types.o cp_parser_ilist_types.o cp_parser_types.o cp_parser_ilist_methods.o input_keyword_types.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kinput.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kinput.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kinput.a cp_parser_buffer_types.o cp_parser_methods.o input_enumeration_types.o cp_parser_status_types.o input_parsing.o cp_output_handling.o cp_parser_inpp_types.o input_val_types.o cp_linked_list_input.o cp_parser_inpp_methods.o input_section_types.o cp_parser_ilist_types.o cp_parser_types.o cp_parser_ilist_methods.o input_keyword_types.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kinput.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_linked_list_pw.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/cp_linked_list_pw.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_linked_list.fypp realspace_grid_types.mod pw_types.mod base_hooks.mod kinds.mod cp_array_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/cp_linked_list_pw.F cp_linked_list_pw.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/cp_linked_list_pw.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_linked_list_pw.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_linked_list_pw.mod' due to: cp_linked_list_pw.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/cp_linked_list_pw.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_linked_list.fypp realspace_grid_types.mod pw_types.mod base_hooks.mod kinds.mod cp_array_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pw_pool_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_pool_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod base_hooks.mod cp_log_handling.mod kinds.mod timings.mod pw_methods.mod cp_linked_list_pw.mod pw_grids.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_pool_types.F pw_pool_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_pool_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_pool_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pw_pool_types.mod' due to: pw_pool_types.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_pool_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod base_hooks.mod cp_log_handling.mod kinds.mod timings.mod pw_methods.mod cp_linked_list_pw.mod pw_grids.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'dielectric_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/dielectric_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod pw_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/dielectric_types.F dielectric_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:28 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/dielectric_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dielectric_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'dct.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/dct.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod base_hooks.mod kinds.mod message_passing.mod fast.mod pw_grids.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/dct.F dct.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:29 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/dct.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dct.F90 /build/cp2k-Q381vr/cp2k-8.1/src/pw/dct.F:459:59: 459 | ALLOCATE (srcs_expand_all(maxn_sendrecv, group_size)) | ^ Warning: ‘maxn_sendrecv’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw/dct.F:1109:46: 1109 | ALLOCATE (pcs_bnds(2, 3, maxn_sendrecv)) | ^ Warning: ‘maxn_sendrecv’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw/dct.F:1118:63: 1118 | bounds_shftd(:, 3) = bounds(:, 3) + shf_yesno(3)*shift(3) | ^ Warning: ‘shf_yesno[2]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw/dct.F:1117:63: 1117 | bounds_shftd(:, 2) = bounds(:, 2) + shf_yesno(2)*shift(2) | ^ Warning: ‘shf_yesno[1]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw/dct.F:1116:63: 1116 | bounds_shftd(:, 1) = bounds(:, 1) + shf_yesno(1)*shift(1) | ^ Warning: ‘shf_yesno[0]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw/dct.F:562:67: 562 | ALLOCATE (recv_reqs(maxn_sendrecv), send_reqs(maxn_sendrecv)) | ^ Warning: ‘maxn_sendrecv’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw/dct.F:675:53: 675 | cr3d_xpndd(:, :, ind:ub3_new) = catd_flipdbf | ^ Warning: ‘ind’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw/dct.F:216:42: 216 | ALLOCATE (flipg_stat(maxn_sendrecv)) | ^ Warning: ‘maxn_sendrecv’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw/dct.F:229:44: 229 | hmat2(3, 3) = scfac(3)*cell_hmat(3, 3) | ^ Warning: ‘scfac[2]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw/dct.F:228:44: 228 | hmat2(2, 2) = scfac(2)*cell_hmat(2, 2) | ^ Warning: ‘scfac[1]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw/dct.F:227:44: 227 | hmat2(1, 1) = scfac(1)*cell_hmat(1, 1) | ^ Warning: ‘scfac[0]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw/dct.F:113:50: 113 | ALLOCATE (dct_env%flipg_stat(maxn_sendrecv)) | ^ Warning: ‘maxn_sendrecv’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'structure_factors.mod' due to: structure_factors.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'dgs.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/dgs.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod realspace_grid_types.mod base_hooks.mod kinds.mod mathlib.mod fft_tools.mod fast.mod pw_grid_info.mod pw_grids.mod structure_factors.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/dgs.F dgs.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:36 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/dgs.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dgs.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'lazy.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/lazy.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/lazy.F lazy.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:39 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/lazy.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lazy.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'lazy.mod' due to: lazy.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/lazy.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ps_wavelet_scaling_function.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_scaling_function.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod lazy.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_scaling_function.F ps_wavelet_scaling_function.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:41 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_wavelet_scaling_function.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_wavelet_scaling_function.F90 /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_scaling_function.F:92:30: 92 | SUBROUTINE wavelet_function(itype, nd, a, x) | ^ Warning: ‘wavelet_function’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_scaling_function.F:196:23: 196 | SUBROUTINE for_trans(nd, nt, x, y, m, cgt, cht) | ^ Warning: ‘for_trans’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_scaling_function.F:296:19: 296 | SUBROUTINE ftest(m, ch, cg, cgt, cht) | ^ Warning: ‘ftest’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ps_wavelet_scaling_function.mod' due to: ps_wavelet_scaling_function.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_scaling_function.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod lazy.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ps_wavelet_fft3d.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_fft3d.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_fft3d.F ps_wavelet_fft3d.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:42 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_wavelet_fft3d.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_wavelet_fft3d.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ps_wavelet_fft3d.mod' due to: ps_wavelet_fft3d.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_fft3d.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ps_wavelet_base.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_base.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 ps_wavelet_fft3d.mod kinds.mod message_passing.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_base.F ps_wavelet_base.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:48 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_wavelet_base.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_wavelet_base.F90 /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_base.F:2103:31: 2103 | SUBROUTINE F_unfill_downcorn(md1, md3, lot, nfft, n3, zw, zf, scal, ehartreetmp) | ^ Warning: ‘f_unfill_downcorn’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ps_wavelet_base.mod' due to: ps_wavelet_base.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_base.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 ps_wavelet_fft3d.mod kinds.mod message_passing.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ps_wavelet_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_util.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod base_hooks.mod kinds.mod mathconstants.mod ps_wavelet_base.mod ps_wavelet_fft3d.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_util.F ps_wavelet_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_wavelet_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_wavelet_util.F90 /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_util.F:155:58: 155 | DO i2 = istart + 1, MIN(nlim, istart + md2/nproc) | ^ Warning: ‘nlim’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ps_wavelet_util.mod' due to: ps_wavelet_util.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_util.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod base_hooks.mod kinds.mod mathconstants.mod ps_wavelet_base.mod ps_wavelet_fft3d.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ps_wavelet_kernel.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_kernel.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 ps_wavelet_scaling_function.mod base_hooks.mod kinds.mod ps_wavelet_base.mod message_passing.mod ps_wavelet_fft3d.mod ps_wavelet_util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_kernel.F ps_wavelet_kernel.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:38:55 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_wavelet_kernel.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_wavelet_kernel.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'dirichlet_bc_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/dirichlet_bc_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod pw_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/dirichlet_bc_types.F dirichlet_bc_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:39:00 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/dirichlet_bc_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dirichlet_bc_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'dirichlet_bc_types.mod' due to: dirichlet_bc_types.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/dirichlet_bc_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod pw_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ps_wavelet_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_types.F ps_wavelet_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:39:00 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_wavelet_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_wavelet_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ps_wavelet_types.mod' due to: ps_wavelet_types.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'dielectric_types.mod' due to: dielectric_types.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'dct.mod' due to: dct.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ps_implicit_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_implicit_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dirichlet_bc_types.mod pw_pool_types.mod pw_types.mod dielectric_types.mod base_hooks.mod kinds.mod dct.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_implicit_types.F ps_implicit_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:39:00 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_implicit_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_implicit_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ps_implicit_types.mod' due to: ps_implicit_types.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_implicit_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dirichlet_bc_types.mod pw_pool_types.mod pw_types.mod dielectric_types.mod base_hooks.mod kinds.mod dct.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'bessel_lib.mod' due to: bessel_lib.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mt_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/mt_util.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_pool_types.mod pw_types.mod base_hooks.mod kinds.mod mathconstants.mod bibliography.mod pw_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/mt_util.F mt_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:39:01 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/mt_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mt_util.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mt_util.mod' due to: mt_util.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/mt_util.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_pool_types.mod pw_types.mod base_hooks.mod kinds.mod mathconstants.mod bibliography.mod pw_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pw_poisson_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_poisson_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod dirichlet_bc_types.mod pw_pool_types.mod ps_wavelet_types.mod ps_implicit_types.mod realspace_grid_types.mod dielectric_types.mod base_hooks.mod kinds.mod mathconstants.mod bessel_lib.mod mt_util.mod pw_grids.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_poisson_types.F pw_poisson_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:39:02 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_poisson_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_poisson_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_poisson_types.F:445:29: 445 | SUBROUTINE pw_green_retain(gftype) | ^ Warning: ‘pw_green_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pw_poisson_types.mod' due to: pw_poisson_types.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_poisson_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod dirichlet_bc_types.mod pw_pool_types.mod ps_wavelet_types.mod ps_implicit_types.mod realspace_grid_types.mod dielectric_types.mod base_hooks.mod kinds.mod mathconstants.mod bessel_lib.mod mt_util.mod pw_grids.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ps_wavelet_kernel.mod' due to: ps_wavelet_kernel.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ps_wavelet_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_poisson_types.mod ps_wavelet_types.mod pw_types.mod base_hooks.mod kinds.mod util.mod bibliography.mod ps_wavelet_kernel.mod message_passing.mod ps_wavelet_util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_methods.F ps_wavelet_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:39:04 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_wavelet_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_wavelet_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'dg_rho0_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/dg_rho0_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_poisson_types.mod pw_types.mod base_hooks.mod kinds.mod pw_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/dg_rho0_types.F dg_rho0_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:39:06 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/dg_rho0_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dg_rho0_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rs_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/rs_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_pool_types.mod realspace_grid_types.mod pw_types.mod base_hooks.mod kinds.mod pw_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/rs_methods.F rs_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:39:06 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/rs_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rs_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'dg_rho0_types.mod' due to: dg_rho0_types.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'dg_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/dg_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dg_rho0_types.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/dg_types.F dg_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:39:09 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/dg_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dg_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'realspace_grid_cube.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/realspace_grid_cube.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod base_hooks.mod cp_log_handling.mod kinds.mod message_passing.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/realspace_grid_cube.F realspace_grid_cube.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:39:09 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/realspace_grid_cube.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' realspace_grid_cube.F90 /build/cp2k-Q381vr/cp2k-8.1/src/pw/realspace_grid_cube.F:771:65: 771 | IF (MODULO(counter, num_entries_line) == 0 .OR. k == last_z) & | ^ Warning: ‘last_z’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw/realspace_grid_cube.F:642:97: 642 | INTEGER :: counter, gid, i, islice, j, k, last_z, & | ^ note: ‘last_z’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pw_spline_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_spline_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_pool_types.mod pw_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathconstants.mod pw_methods.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_spline_utils.F pw_spline_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:39:11 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_spline_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_spline_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_spline_utils.F:2620:38: 2620 | SUBROUTINE pw_spline_precond_retain(preconditioner) | ^ Warning: ‘pw_spline_precond_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_spline_utils.F:953:87: 953 | weights(i, j, k) = REAL(idirVal, dp)*coeffs(ABS(i) + ABS(j) + ABS(k)) | ^ Warning: ‘idirval’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rs_methods.mod' due to: rs_methods.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'dielectric_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/dielectric_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_pool_types.mod realspace_grid_types.mod pw_types.mod dielectric_types.mod rs_methods.mod base_hooks.mod kinds.mod dct.mod mathconstants.mod pw_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/dielectric_methods.F dielectric_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:39:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/dielectric_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dielectric_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'dielectric_methods.mod' due to: dielectric_methods.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'dirichlet_bc_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/dirichlet_bc_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod dirichlet_bc_types.mod pw_pool_types.mod pw_poisson_types.mod ps_implicit_types.mod pw_types.mod rs_methods.mod base_hooks.mod cp_log_handling.mod mathlib.mod kinds.mod mathconstants.mod physcon.mod pw_methods.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/dirichlet_bc_methods.F dirichlet_bc_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:39:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/dirichlet_bc_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dirichlet_bc_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/pw/dirichlet_bc_methods.F:899:13: 899 | IF (h .GT. MINVAL((/Lx, Lz/))) THEN | ^ Warning: ‘h’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw/dirichlet_bc_methods.F:814:89: 814 | REAL(dp) :: cntrlaxis_lb, cntrlaxis_ub, h, Lx, Ly, & | ^ note: ‘h’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'dirichlet_bc_methods.mod' due to: dirichlet_bc_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/dirichlet_bc_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod dirichlet_bc_types.mod pw_pool_types.mod pw_poisson_types.mod ps_implicit_types.mod pw_types.mod rs_methods.mod base_hooks.mod cp_log_handling.mod mathlib.mod kinds.mod mathconstants.mod physcon.mod pw_methods.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ps_implicit_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_implicit_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod dirichlet_bc_types.mod pw_pool_types.mod pw_poisson_types.mod ps_implicit_types.mod pw_types.mod dielectric_types.mod base_hooks.mod cp_log_handling.mod kinds.mod dct.mod kahan_sum.mod dielectric_methods.mod dirichlet_bc_methods.mod mathconstants.mod bibliography.mod pw_methods.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_implicit_methods.F ps_implicit_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:39:32 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_implicit_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_implicit_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_implicit_methods.F:1199:87: 1199 | CALL pw_scale(pw_in, 1.0_dp/(vol_scfac*tile_volume)) ! normalize tile_pw | ^ Warning: ‘vol_scfac’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_implicit_methods.F:958:92: 958 | CALL ps_implicit_report_ehartree(ps_implicit_env, outp_unit, ehartree/vol_scfac) | ^ Warning: ‘vol_scfac’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_implicit_methods.F:433:57: 433 | ps_implicit_env%ehartree = ehartree/vol_scfac | ^ Warning: ‘vol_scfac’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ps_implicit_methods.mod' due to: ps_implicit_methods.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ps_wavelet_methods.mod' due to: ps_wavelet_methods.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pw_poisson_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_poisson_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod pw_pool_types.mod pw_poisson_types.mod ps_wavelet_types.mod ps_implicit_types.mod base_hooks.mod cp_log_handling.mod kinds.mod dielectric_methods.mod mathconstants.mod ps_implicit_methods.mod ps_wavelet_methods.mod pw_methods.mod mt_util.mod pw_grids.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw/pw_poisson_methods.F pw_poisson_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:39:42 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_poisson_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_poisson_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw.a' due to: dielectric_types.o dct.o dgs.o ps_wavelet_kernel.o fft_tools.o ps_wavelet_methods.o dg_rho0_types.o rs_methods.o cube_utils.o pw_methods.o dg_types.o mt_util.o lazy.o pw_types.o realspace_grid_cube.o ps_wavelet_types.o pw_grid_info.o pw_spline_utils.o dielectric_methods.o ps_wavelet_fft3d.o pw_grids.o realspace_grid_types.o pw_grid_types.o ps_wavelet_scaling_function.o pw_pool_types.o ps_implicit_types.o pw_fpga.o ps_wavelet_base.o ps_implicit_methods.o cp_linked_list_pw.o dirichlet_bc_types.o pw_poisson_methods.o pw_cuda.o fast.o pw_poisson_types.o ps_wavelet_util.o dirichlet_bc_methods.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw.a dielectric_types.o dct.o dgs.o ps_wavelet_kernel.o fft_tools.o ps_wavelet_methods.o dg_rho0_types.o rs_methods.o cube_utils.o pw_methods.o dg_types.o mt_util.o lazy.o pw_types.o realspace_grid_cube.o ps_wavelet_types.o pw_grid_info.o pw_spline_utils.o dielectric_methods.o ps_wavelet_fft3d.o pw_grids.o realspace_grid_types.o pw_grid_types.o ps_wavelet_scaling_function.o pw_pool_types.o ps_implicit_types.o pw_fpga.o ps_wavelet_base.o ps_implicit_methods.o cp_linked_list_pw.o dirichlet_bc_types.o pw_poisson_methods.o pw_cuda.o fast.o pw_poisson_types.o ps_wavelet_util.o dirichlet_bc_methods.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfft.a' due to: fft_kinds.o fftsg_lib.o fft_plan.o fft_lib.o fftw3_lib.o mltfftsg_tools.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfft.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfft.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfft.a fft_kinds.o fftsg_lib.o fft_plan.o fft_lib.o fftw3_lib.o mltfftsg_tools.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfft.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'fft_fpga.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/fpga/fft_fpga.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/pw/fpga/opencl_utils.h /build/cp2k-Q381vr/cp2k-8.1/src/pw/fpga/fft_fpga.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/pw/fpga/fft_fpga.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'opencl_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw/fpga/opencl_utils.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/pw/fpga/opencl_utils.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfpga.a' due to: fft_fpga.o opencl_utils.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfpga.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfpga.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfpga.a fft_fpga.o opencl_utils.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfpga.a /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/all.dep:151: update target '/build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran/grid_miniapp.psmp' due to: grid_miniapp.o /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgrid.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridhybrid.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcpu.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridref.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcommon.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ksubsys.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfm.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kao.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kinput.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfft.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmpiwrap.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfpga.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:39:44 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran/grid_miniapp.psmp grid_miniapp.o -lcp2kgrid -lcp2kgridhybrid -lcp2kgridcpu -lcp2kgridref -lcp2kgridcommon -lcp2ksubsys -lcp2kfm -lcp2kao -lcp2kinput -lcp2kpw -lcp2kfft -lcp2kcommon -lcp2kmpiwrap -lcp2kfpga -lcp2kbase -L/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'grid_unittest.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_unittest.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_replay.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_library.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_sphere_cache.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_unittest.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/all.dep:147: update target '/build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran/grid_unittest.psmp' due to: grid_unittest.o /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgrid.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridhybrid.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcpu.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridref.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcommon.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ksubsys.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfm.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kao.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kinput.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfft.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmpiwrap.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfpga.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:39:44 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran/grid_unittest.psmp grid_unittest.o -lcp2kgrid -lcp2kgridhybrid -lcp2kgridcpu -lcp2kgridref -lcp2kgridcommon -lcp2ksubsys -lcp2kfm -lcp2kao -lcp2kinput -lcp2kpw -lcp2kfft -lcp2kcommon -lcp2kmpiwrap -lcp2kfpga -lcp2kbase -L/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'graph_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph_utils.F graph_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:39:45 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"metadyn_tools/graph_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' graph_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'graph_utils.mod' due to: graph_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'graph_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod physcon.mod memory_utilities.mod cp_files.mod string_utilities.mod periodic_table.mod graph_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph_methods.F graph_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:39:45 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"metadyn_tools/graph_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' graph_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph_methods.F:499:94: 499 | dx(:, irep) = dx(:, irep) + 0.5_dp*mep_input_data%kb*(yy0 - avg2)*(dyy - davg2) | ^ Warning: ‘yy0’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph_methods.F:496:94: 496 | dx(:, irep) = dx(:, irep) + 0.5_dp*mep_input_data%kb*(xx0 - avg2)*(dxx - davg2) | ^ Warning: ‘xx0’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph_methods.F:174:65: 174 | array(ind) = MINVAL(-fes(pnt:pnt + dimval - 1)) | ^ Warning: ‘ind’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'graph_methods.mod' due to: graph_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod physcon.mod memory_utilities.mod cp_files.mod string_utilities.mod periodic_table.mod graph_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'graph.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod mathconstants.mod graph_methods.mod cp_files.mod graph_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph.F graph.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:39:52 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"metadyn_tools/graph.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' graph.F90 /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph.F:658:28: 658 | out3 = out2//"." | 1 Warning: CHARACTER expression will be truncated in assignment (80/81) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph.F:660:28: 660 | out3 = out1//"." | 1 Warning: CHARACTER expression will be truncated in assignment (80/81) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph.F:496:39: 496 | READ (a, *) (ss0(i_map(id), i), id=1, ndim) | ^ Warning: ‘ss0.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph.F:60:51: 60 | gauss(:, :), ss0(:, :), tmpr(:), ww(:), x0(:), xf(:) | ^ Warning: ‘ss0.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph.F:496:39: 496 | READ (a, *) (ss0(i_map(id), i), id=1, ndim) | ^ Warning: ‘ss0.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph.F:59:53: 59 | REAL(KIND=dp), POINTER :: delta_s(:, :), dp_cut(:), dp_grid(:), fes(:), & | ^ Warning: ‘dp_cut.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph.F:49:76: 49 | ngrid(:), nn(:, :), nn_max(:), & | ^ Warning: ‘nn_max.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph.F:60:67: 60 | gauss(:, :), ss0(:, :), tmpr(:), ww(:), x0(:), xf(:) | ^ Warning: ‘ww.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph.F:59:42: 59 | REAL(KIND=dp), POINTER :: delta_s(:, :), dp_cut(:), dp_grid(:), fes(:), & | ^ Warning: ‘delta_s.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph.F:59:42: Warning: ‘delta_s.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph.F:505:43: 505 | READ (a, *) (delta_s(i_map(id), i), id=1, ndim) | ^ Warning: ‘delta_s.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph.F:60:81: 60 | gauss(:, :), ss0(:, :), tmpr(:), ww(:), x0(:), xf(:) | ^ Warning: ‘xf.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/metadyn_tools/graph.F:585:35: 585 | j = MINLOC((i_map - i)**2, 1) | ^ Warning: ‘i_map.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmetadyn_tools.a' due to: graph_methods.o graph_utils.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmetadyn_tools.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmetadyn_tools.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmetadyn_tools.a graph_methods.o graph_utils.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmetadyn_tools.a /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/all.dep:123: update target '/build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran/graph.psmp' due to: graph.o /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmetadyn_tools.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmpiwrap.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:39:57 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran/graph.psmp graph.o -lcp2kmetadyn_tools -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'dumpdcd.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/dumpdcd.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/dumpdcd.F dumpdcd.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:39:57 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/dumpdcd.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dumpdcd.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/dumpdcd.F:710:118: 710 | WRITE (UNIT=output_unit, FMT=fmt_string) ADJUSTL(atomic_label(iatom)), s_pbc(iatom, 1:3) | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&s_pbc].dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/dumpdcd.F:84:77: 84 | REAL(KIND=dp), DIMENSION(:, :), ALLOCATABLE :: r_pbc, r0, s, s_pbc | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&s_pbc].dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/dumpdcd.F:706:114: 706 | WRITE (UNIT=output_unit, FMT=fmt_string) ADJUSTL(atomic_label(iatom)), s(iatom, 1:3) | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&s].dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/dumpdcd.F:84:63: 84 | REAL(KIND=dp), DIMENSION(:, :), ALLOCATABLE :: r_pbc, r0, s, s_pbc | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&r_pbc].dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/dumpdcd.F:643:54: 643 | r(:, :) = REAL(r_pbc(:, :), KIND=sp) | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&r_pbc].dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/dumpdcd.F:84:63: 84 | REAL(KIND=dp), DIMENSION(:, :), ALLOCATABLE :: r_pbc, r0, s, s_pbc | ^ Warning: ‘r_pbc.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/dumpdcd.F:652:87: 652 | (r(iatom, 3) - r0(iatom, 3))**2) | ^ Warning: ‘r0.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/dumpdcd.F:652:87: Warning: ‘r0.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/dumpdcd.F:668:83: 668 | WRITE (UNIT=output_unit) REAL(atomic_displacement(:), KIND=sp) | ^ Warning: ‘atomic_displacement.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'splines_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/splines_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/splines_types.F splines_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:01 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"splines_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' splines_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/splines_types.F:193:31: 193 | SUBROUTINE spline_env_retain(spline_env) | ^ Warning: ‘spline_env_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'splines_types.mod' due to: splines_types.o /build/cp2k-Q381vr/cp2k-8.1/src/splines_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'helium_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 splines_types.mod parallel_rng_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_types.F helium_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:02 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/helium_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' helium_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_types.F:383:41: 383 | SUBROUTINE helium_destroy_real_arr_ptr(real_arr_p) | ^ Warning: ‘helium_destroy_real_arr_ptr’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_subsys_types.mod' due to: cp_subsys_types.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'global_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/global_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod base_hooks.mod kinds.mod cp_blacs_env.mod machine.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/global_types.F global_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:02 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"global_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' global_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'global_types.mod' due to: global_types.o /build/cp2k-Q381vr/cp2k-8.1/src/global_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod base_hooks.mod kinds.mod cp_blacs_env.mod machine.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_constants.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_constants.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_constants.F input_constants.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:02 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_constants.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_constants.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_constants.mod' due to: input_constants.o /build/cp2k-Q381vr/cp2k-8.1/src/input_constants.F kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'dimer_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/dimer_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod input_section_types.mod molecule_kind_list_types.mod molecule_kind_types.mod cell_types.mod global_types.mod base_hooks.mod cp_log_handling.mod kinds.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/dimer_types.F dimer_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:03 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/dimer_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dimer_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'dimer_types.mod' due to: dimer_types.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/dimer_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod input_section_types.mod molecule_kind_list_types.mod molecule_kind_types.mod cell_types.mod global_types.mod base_hooks.mod cp_log_handling.mod kinds.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'dimer_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/dimer_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dimer_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod memory_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/dimer_utils.F dimer_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:04 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/dimer_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dimer_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'reftraj_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/reftraj_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/reftraj_types.F reftraj_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:04 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/reftraj_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' reftraj_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'reftraj_types.mod' due to: reftraj_types.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/reftraj_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'free_energy_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/free_energy_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/free_energy_types.F free_energy_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:05 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"free_energy_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' free_energy_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'free_energy_types.mod' due to: free_energy_types.o /build/cp2k-Q381vr/cp2k-8.1/src/free_energy_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_energy_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy_types.F qs_energy_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:05 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_energy_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_energy_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_energy_types.mod' due to: qs_energy_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'domain_submatrix_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/domain_submatrix_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/domain_submatrix_types.F domain_submatrix_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:05 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"domain_submatrix_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' domain_submatrix_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'domain_submatrix_types.mod' due to: domain_submatrix_types.o /build/cp2k-Q381vr/cp2k-8.1/src/domain_submatrix_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'almo_scf_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod domain_submatrix_types.mod base_hooks.mod kinds.mod cp_blacs_env.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_types.F almo_scf_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:06 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"almo_scf_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' almo_scf_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'almo_scf_types.mod' due to: almo_scf_types.o /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod domain_submatrix_types.mod base_hooks.mod kinds.mod cp_blacs_env.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pexsi_interface.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pexsi_interface.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pexsi_interface.F pexsi_interface.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:09 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pexsi_interface.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pexsi_interface.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pexsi_interface.mod' due to: pexsi_interface.o /build/cp2k-Q381vr/cp2k-8.1/src/pexsi_interface.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pexsi_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pexsi_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod cp_log_handling.mod bibliography.mod message_passing.mod pexsi_interface.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pexsi_types.F pexsi_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:09 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pexsi_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pexsi_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pexsi_types.mod' due to: pexsi_types.o /build/cp2k-Q381vr/cp2k-8.1/src/pexsi_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod cp_log_handling.mod bibliography.mod message_passing.mod pexsi_interface.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_rho_atom_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho_atom_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho_atom_types.F qs_rho_atom_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:10 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_rho_atom_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_rho_atom_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_rho_atom_types.mod' due to: qs_rho_atom_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho_atom_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'distribution_2d_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/distribution_2d_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod cp_log_handling.mod cp_array_utils.mod cp_blacs_env.mod machine.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/distribution_2d_types.F distribution_2d_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:11 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"distribution_2d_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' distribution_2d_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'distribution_2d_types.mod' due to: distribution_2d_types.o /build/cp2k-Q381vr/cp2k-8.1/src/distribution_2d_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod cp_log_handling.mod cp_array_utils.mod cp_blacs_env.mod machine.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_dbcsr_operations.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/cp_dbcsr_operations.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_cfm_types.mod distribution_2d_types.mod cp_fm_types.mod base_hooks.mod mathlib.mod kinds.mod cp_fm_struct.mod cp_blacs_env.mod cp_fm_basic_linalg.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/cp_dbcsr_operations.F cp_dbcsr_operations.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:12 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_dbcsr_operations.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_dbcsr_operations.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_dbcsr_operations.mod' due to: cp_dbcsr_operations.o /build/cp2k-Q381vr/cp2k-8.1/src/cp_dbcsr_operations.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_cfm_types.mod distribution_2d_types.mod cp_fm_types.mod base_hooks.mod mathlib.mod kinds.mod cp_fm_struct.mod cp_blacs_env.mod cp_fm_basic_linalg.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_density_mixing_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_density_mixing_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod qs_rho_atom_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_dbcsr_operations.mod string_utilities.mod input_constants.mod ao_util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_density_mixing_types.F qs_density_mixing_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:16 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_density_mixing_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_density_mixing_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_density_mixing_types.mod' due to: qs_density_mixing_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_density_mixing_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod qs_rho_atom_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_dbcsr_operations.mod string_utilities.mod input_constants.mod ao_util.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'linesearch.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/linesearch.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_output_handling.mod string_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/linesearch.F linesearch.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:18 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"linesearch.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' linesearch.F90 /build/cp2k-Q381vr/cp2k-8.1/src/linesearch.F:321:32: 321 | this%step_size = step_size | ^ Warning: ‘step_size’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/linesearch.F:322:27: 322 | this%starts = is_done | ^ Warning: ‘is_done’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'linesearch.mod' due to: linesearch.o /build/cp2k-Q381vr/cp2k-8.1/src/linesearch.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_output_handling.mod string_utilities.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pao_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pao_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 kinds.mod linesearch.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pao_types.F pao_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:18 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pao_types.mod' due to: pao_types.o /build/cp2k-Q381vr/cp2k-8.1/src/pao_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 kinds.mod linesearch.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'dm_ls_scf_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pexsi_types.mod cp_para_types.mod qs_density_mixing_types.mod pao_types.mod input_section_types.mod cp_para_env.mod base_hooks.mod kinds.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_types.F dm_ls_scf_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:19 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dm_ls_scf_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dm_ls_scf_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'dm_ls_scf_types.mod' due to: dm_ls_scf_types.o /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pexsi_types.mod cp_para_types.mod qs_density_mixing_types.mod pao_types.mod input_section_types.mod cp_para_env.mod base_hooks.mod kinds.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'semi_empirical_mpole_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_mpole_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_mpole_types.F semi_empirical_mpole_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:21 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_mpole_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_mpole_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'semi_empirical_mpole_types.mod' due to: semi_empirical_mpole_types.o /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_mpole_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'dg_types.mod' due to: dg_types.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'semi_empirical_expns3_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_expns3_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_expns3_types.F semi_empirical_expns3_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:21 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_expns3_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_expns3_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'semi_empirical_expns3_types.mod' due to: semi_empirical_expns3_types.o /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_expns3_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'taper_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/taper_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/taper_types.F taper_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:21 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"taper_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' taper_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'taper_types.mod' due to: taper_types.o /build/cp2k-Q381vr/cp2k-8.1/src/taper_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'semi_empirical_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_mpole_types.mod basis_set_types.mod dg_types.mod pw_pool_types.mod semi_empirical_expns3_types.mod taper_types.mod input_section_types.mod multipole_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_types.F semi_empirical_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:22 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_types.F:456:26: 456 | SUBROUTINE set_se_param(sep, name, typ, defined, z, zeff, natorb, eheat, & | ^ Warning: ‘set_se_param’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'semi_empirical_types.mod' due to: semi_empirical_types.o /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_mpole_types.mod basis_set_types.mod dg_types.mod pw_pool_types.mod semi_empirical_expns3_types.mod taper_types.mod input_section_types.mod multipole_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_neighbor_list_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_neighbor_list_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_neighbor_list_types.F qs_neighbor_list_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:24 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_neighbor_list_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_neighbor_list_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_neighbor_list_types.F:334:28: 334 | iterator%nnode = nnode | ^ Warning: ‘nnode’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_neighbor_list_types.F:339:45: 339 | iterator%neighbor_list => neighbor_list | ^ Warning: ‘neighbor_list’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_neighbor_list_types.F:332:28: 332 | iterator%nlist = nlist | ^ Warning: ‘nlist’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_neighbor_list_types.F:331:28: 331 | iterator%ilist = ilist | ^ Warning: ‘ilist’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_neighbor_list_types.F:227:61: 227 | list_search(il)%atom_list(ilist) = iatom | ^ Warning: ‘iatom’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_neighbor_list_types.mod' due to: qs_neighbor_list_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_neighbor_list_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod util.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_tensors_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_tensors_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod qs_neighbor_list_types.mod particle_types.mod atomic_kind_types.mod distribution_2d_types.mod cp_para_env.mod base_hooks.mod cp_array_utils.mod cp_blacs_env.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_tensors_types.F qs_tensors_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:25 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tensors_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tensors_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_tensors_types.mod' due to: qs_tensors_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_tensors_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod qs_neighbor_list_types.mod particle_types.mod atomic_kind_types.mod distribution_2d_types.mod cp_para_env.mod base_hooks.mod cp_array_utils.mod cp_blacs_env.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'basis_set_container_types.mod' due to: basis_set_container_types.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'hirshfeld_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/hirshfeld_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_types.mod base_hooks.mod kinds.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/hirshfeld_types.F hirshfeld_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hirshfeld_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hirshfeld_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'hirshfeld_types.mod' due to: hirshfeld_types.o /build/cp2k-Q381vr/cp2k-8.1/src/hirshfeld_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_types.mod base_hooks.mod kinds.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_cdft_opt_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_opt_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_opt_types.F qs_cdft_opt_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_cdft_opt_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_cdft_opt_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_cdft_opt_types.mod' due to: qs_cdft_opt_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_opt_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'outer_scf_control_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/outer_scf_control_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod qs_cdft_opt_types.mod base_hooks.mod kinds.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/outer_scf_control_types.F outer_scf_control_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:28 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"outer_scf_control_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' outer_scf_control_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'outer_scf_control_types.mod' due to: outer_scf_control_types.o /build/cp2k-Q381vr/cp2k-8.1/src/outer_scf_control_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod qs_cdft_opt_types.mod base_hooks.mod kinds.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_cdft_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hirshfeld_types.mod qs_cdft_opt_types.mod outer_scf_control_types.mod pw_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_array_utils.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_types.F qs_cdft_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:28 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_cdft_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_cdft_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_types.F:501:33: 501 | SUBROUTINE cdft_control_retain(cdft_control) | ^ Warning: ‘cdft_control_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_cdft_types.mod' due to: qs_cdft_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hirshfeld_types.mod qs_cdft_opt_types.mod outer_scf_control_types.mod pw_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_array_utils.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pair_potential_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pair_potential_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 splines_types.mod kinds.mod memory_utilities.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pair_potential_types.F pair_potential_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:30 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pair_potential_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pair_potential_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/pair_potential_types.F:817:69: 817 | INTEGER :: i, loc_lb, loc_ub | ^ Warning: ‘loc_lb’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pair_potential_types.mod' due to: pair_potential_types.o /build/cp2k-Q381vr/cp2k-8.1/src/pair_potential_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 splines_types.mod kinds.mod memory_utilities.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xas_control.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xas_control.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod memory_utilities.mod cp_output_handling.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xas_control.F xas_control.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:33 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_control.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_control.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xas_control.F:326:32: 326 | SUBROUTINE xas_control_retain(xas_control) | ^ Warning: ‘xas_control_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xas_control.mod' due to: xas_control.o /build/cp2k-Q381vr/cp2k-8.1/src/xas_control.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod memory_utilities.mod cp_output_handling.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_control_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/cp_control_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_cdft_types.mod pair_potential_types.mod cp_fm_types.mod base_hooks.mod kinds.mod input_constants.mod xas_control.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/cp_control_types.F cp_control_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:33 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_control_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_control_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/cp_control_types.F:654:37: 654 | SUBROUTINE mulliken_control_retain(mulliken_restraint_control) | ^ Warning: ‘mulliken_control_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/cp_control_types.F:717:34: 717 | SUBROUTINE ddapc_control_retain(ddapc_restraint_control) | ^ Warning: ‘ddapc_control_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/cp_control_types.F:770:31: 770 | SUBROUTINE s2_control_retain(s2_restraint_control) | ^ Warning: ‘s2_control_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_control_types.mod' due to: cp_control_types.o /build/cp2k-Q381vr/cp2k-8.1/src/cp_control_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_cdft_types.mod pair_potential_types.mod cp_fm_types.mod base_hooks.mod kinds.mod input_constants.mod xas_control.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xtb_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xtb_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_output_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xtb_types.F xtb_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:35 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xtb_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xtb_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xtb_types.mod' due to: xtb_types.o /build/cp2k-Q381vr/cp2k-8.1/src/xtb_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_output_handling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'atom_upf.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/atom_upf.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_parser_types.mod base_hooks.mod kinds.mod cp_parser_methods.mod periodic_table.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/atom_upf.F atom_upf.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:36 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_upf.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_upf.F90 /build/cp2k-Q381vr/cp2k-8.1/src/atom_upf.F:519:33: 519 | ALLOCATE (pot%rab(m)) | ^ Warning: ‘m’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/atom_upf.F:447:69: 447 | INTEGER :: icount, m, mc, ms | ^ note: ‘m’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'atom_upf.mod' due to: atom_upf.o /build/cp2k-Q381vr/cp2k-8.1/src/atom_upf.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_parser_types.mod base_hooks.mod kinds.mod cp_parser_methods.mod periodic_table.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_grid_atom.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_grid_atom.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod mathconstants.mod lebedev.mod memory_utilities.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_grid_atom.F qs_grid_atom.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:38 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_grid_atom.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_grid_atom.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_grid_atom.mod' due to: qs_grid_atom.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_grid_atom.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod mathconstants.mod lebedev.mod memory_utilities.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'atom_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/atom_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod cp_parser_types.mod input_section_types.mod base_hooks.mod atom_upf.mod kinds.mod mathconstants.mod bibliography.mod string_utilities.mod cp_linked_list_input.mod input_constants.mod bessel_lib.mod periodic_table.mod qs_grid_atom.mod cp_parser_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/atom_types.F atom_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:41 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/atom_types.F:2905:56: 2905 | potential%npot(l) = potential%npot(l) + 1 | ^ Warning: ‘l’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'atom_types.mod' due to: atom_types.o /build/cp2k-Q381vr/cp2k-8.1/src/atom_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod cp_parser_types.mod input_section_types.mod base_hooks.mod atom_upf.mod kinds.mod mathconstants.mod bibliography.mod string_utilities.mod cp_linked_list_input.mod input_constants.mod bessel_lib.mod periodic_table.mod qs_grid_atom.mod cp_parser_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'paw_proj_set_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/paw_proj_set_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_control_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod mathconstants.mod memory_utilities.mod orbital_transformation_matrices.mod cp_output_handling.mod orbital_pointers.mod ao_util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/paw_proj_set_types.F paw_proj_set_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:48 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"paw_proj_set_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' paw_proj_set_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'paw_proj_set_types.mod' due to: paw_proj_set_types.o /build/cp2k-Q381vr/cp2k-8.1/src/paw_proj_set_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_control_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod mathconstants.mod memory_utilities.mod orbital_transformation_matrices.mod cp_output_handling.mod orbital_pointers.mod ao_util.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_dftb_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_types.F qs_dftb_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dftb_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dftb_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_dftb_types.mod' due to: qs_dftb_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_dispersion_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod qs_neighbor_list_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_types.F qs_dispersion_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dispersion_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dispersion_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_dispersion_types.mod' due to: qs_dispersion_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod qs_neighbor_list_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xtb_parameters.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xtb_parameters.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod cp_control_types.mod cp_parser_types.mod xtb_types.mod input_val_types.mod input_section_types.mod base_hooks.mod kinds.mod physcon.mod string_utilities.mod cp_linked_list_input.mod periodic_table.mod cp_parser_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xtb_parameters.F xtb_parameters.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xtb_parameters.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xtb_parameters.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xtb_parameters.F:206:21: 206 | enam = aname | 1 Warning: CHARACTER expression will be truncated in assignment (2/80) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xtb_parameters.mod' due to: xtb_parameters.o /build/cp2k-Q381vr/cp2k-8.1/src/xtb_parameters.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod cp_control_types.mod cp_parser_types.mod xtb_types.mod input_val_types.mod input_section_types.mod base_hooks.mod kinds.mod physcon.mod string_utilities.mod cp_linked_list_input.mod periodic_table.mod cp_parser_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'soft_basis_set.mod' due to: soft_basis_set.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_dftb_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_dftb_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_output_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_utils.F qs_dftb_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:56 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dftb_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dftb_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_dftb_utils.mod' due to: qs_dftb_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_dftb_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_output_handling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'semi_empirical_int_arrays.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_arrays.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_arrays.F semi_empirical_int_arrays.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:40:58 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_int_arrays.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_int_arrays.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'semi_empirical_int_arrays.mod' due to: semi_empirical_int_arrays.o /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_arrays.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'semi_empirical_par_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_par_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod base_hooks.mod kinds.mod mathlib.mod physcon.mod mathconstants.mod semi_empirical_int_arrays.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_par_utils.F semi_empirical_par_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:41:00 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_par_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_par_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_par_utils.F:985:10: 985 | IF (f1 >= f2) THEN | ^ Warning: ‘f2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_par_utils.F:985:10: Warning: ‘f1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_par_utils.F:282:28: 282 | END FUNCTION get_se_basis | ^ Warning: ‘n’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_par_utils.F:254:42: 254 | FUNCTION get_se_basis(sep, l) RESULT(n) | ^ note: ‘n’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'semi_empirical_par_utils.mod' due to: semi_empirical_par_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_par_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod base_hooks.mod kinds.mod mathlib.mod physcon.mod mathconstants.mod semi_empirical_int_arrays.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'semi_empirical_parameters.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_parameters.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod base_hooks.mod kinds.mod semi_empirical_par_utils.mod input_constants.mod physcon.mod periodic_table.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_parameters.F semi_empirical_parameters.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:41:02 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_parameters.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_parameters.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'semi_empirical_parameters.mod' due to: semi_empirical_parameters.o /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_parameters.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod base_hooks.mod kinds.mod semi_empirical_par_utils.mod input_constants.mod physcon.mod periodic_table.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'semi_empirical_mpole_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_mpole_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_mpole_types.mod semi_empirical_types.mod base_hooks.mod kinds.mod semi_empirical_par_utils.mod input_constants.mod semi_empirical_int_arrays.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_mpole_methods.F semi_empirical_mpole_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:41:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_mpole_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_mpole_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'semi_empirical_mpole_methods.mod' due to: semi_empirical_mpole_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_mpole_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_mpole_types.mod semi_empirical_types.mod base_hooks.mod kinds.mod semi_empirical_par_utils.mod input_constants.mod semi_empirical_int_arrays.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'semi_empirical_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod semi_empirical_types.mod cp_control_types.mod cell_types.mod input_section_types.mod base_hooks.mod kinds.mod semi_empirical_par_utils.mod semi_empirical_parameters.mod semi_empirical_mpole_methods.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_utils.F semi_empirical_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:41:24 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'semi_empirical_utils.mod' due to: semi_empirical_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod semi_empirical_types.mod cp_control_types.mod cell_types.mod input_section_types.mod base_hooks.mod kinds.mod semi_empirical_par_utils.mod semi_empirical_parameters.mod semi_empirical_mpole_methods.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'splines.mod' due to: splines.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ai_onecenter.mod' due to: ai_onecenter.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'atom_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/atom_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atom_types.mod mathlib.mod lapack.mod string_utilities.mod input_constants.mod ai_overlap.mod kinds.mod periodic_table.mod splines.mod base_hooks.mod mathconstants.mod physcon.mod ai_onecenter.mod cp_files.mod qs_grid_atom.mod ao_util.mod kahan_sum.mod orbital_transformation_matrices.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/atom_utils.F atom_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:41:25 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/src/atom_utils.F:983:3: 983 | FUNCTION prune_grid(fun, deps) RESULT(nc) | ^ Warning: ‘prune_grid’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/atom_utils.F:1723:74: 1723 | assoc_laguerre(z, REAL(nu, KIND=dp) + 0.5_dp, i - 1) | ^ Warning: ‘res’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/atom_utils.F:2263:34: 2263 | r1 = atom%basis%grid%rad(m1) | ^ Warning: ‘m1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/atom_utils.F:2268:10: 2268 | IF (spinpol) THEN | ^ Warning: ‘spinpol’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'atom_utils.mod' due to: atom_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/atom_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atom_types.mod mathlib.mod lapack.mod string_utilities.mod input_constants.mod ai_overlap.mod kinds.mod periodic_table.mod splines.mod base_hooks.mod mathconstants.mod physcon.mod ai_onecenter.mod cp_files.mod qs_grid_atom.mod ao_util.mod kahan_sum.mod orbital_transformation_matrices.mod orbital_pointers.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'powell.mod' due to: powell.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'atom_sgp.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/atom_sgp.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod base_hooks.mod atom_upf.mod kinds.mod mathlib.mod kahan_sum.mod mathconstants.mod atom_utils.mod ai_onecenter.mod input_constants.mod powell.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/atom_sgp.F atom_sgp.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:41:44 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_sgp.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_sgp.F90 /build/cp2k-Q381vr/cp2k-8.1/src/atom_sgp.F:544:13: 544 | IF (nl_trans) THEN | ^ Warning: ‘nl_trans’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/atom_sgp.F:233:10: 233 | IF (do_transform) THEN | ^ Warning: ‘do_transform’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/atom_sgp.F:234:13: 234 | IF (is_ecp) THEN | ^ Warning: ‘is_ecp’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/atom_sgp.F:237:65: 237 | CALL upf_sgp_constr(upf_pot, sgp_pot, atom_ref%basis) | ^ Warning: ‘upf_pot’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/atom_sgp.F:235:65: 235 | CALL ecp_sgp_constr(ecp_pot, sgp_pot, atom_ref%basis) | ^ Warning: ‘ecp_pot’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/atom_sgp.F:162:25: 162 | error(3) = errcc | ^ Warning: ‘errcc’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'atom_sgp.mod' due to: atom_sgp.o /build/cp2k-Q381vr/cp2k-8.1/src/atom_sgp.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod base_hooks.mod atom_upf.mod kinds.mod mathlib.mod kahan_sum.mod mathconstants.mod atom_utils.mod ai_onecenter.mod input_constants.mod powell.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_harmonics_atom.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_harmonics_atom.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod base_hooks.mod kinds.mod lebedev.mod memory_utilities.mod orbital_transformation_matrices.mod orbital_pointers.mod spherical_harmonics.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_harmonics_atom.F qs_harmonics_atom.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:41:56 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_harmonics_atom.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_harmonics_atom.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_harmonics_atom.mod' due to: qs_harmonics_atom.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_harmonics_atom.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod base_hooks.mod kinds.mod lebedev.mod memory_utilities.mod orbital_transformation_matrices.mod orbital_pointers.mod spherical_harmonics.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_kind_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_kind_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod atomic_kind_types.mod basis_set_types.mod basis_set_container_types.mod cp_control_types.mod xtb_types.mod atom_types.mod paw_proj_set_types.mod qs_dftb_types.mod qs_dispersion_types.mod input_section_types.mod cp_para_types.mod external_potential_types.mod string_utilities.mod input_constants.mod xtb_parameters.mod soft_basis_set.mod atom_upf.mod kinds.mod qs_dftb_utils.mod semi_empirical_utils.mod cp_output_handling.mod periodic_table.mod atom_sgp.mod base_hooks.mod mathconstants.mod physcon.mod qs_grid_atom.mod qs_harmonics_atom.mod cp_log_handling.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_kind_types.F qs_kind_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:41:58 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_kind_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_kind_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_kind_types.mod' due to: qs_kind_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_kind_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod atomic_kind_types.mod basis_set_types.mod basis_set_container_types.mod cp_control_types.mod xtb_types.mod atom_types.mod paw_proj_set_types.mod qs_dftb_types.mod qs_dispersion_types.mod input_section_types.mod cp_para_types.mod external_potential_types.mod string_utilities.mod input_constants.mod xtb_parameters.mod soft_basis_set.mod atom_upf.mod kinds.mod qs_dftb_utils.mod semi_empirical_utils.mod cp_output_handling.mod periodic_table.mod atom_sgp.mod base_hooks.mod mathconstants.mod physcon.mod qs_grid_atom.mod qs_harmonics_atom.mod cp_log_handling.mod orbital_pointers.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_loc_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod distribution_1d_types.mod particle_types.mod cell_types.mod cp_fm_types.mod cp_para_env.mod base_hooks.mod kinds.mod cp_array_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_types.F qs_loc_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:42:08 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_loc_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_loc_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_loc_types.mod' due to: qs_loc_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod distribution_1d_types.mod particle_types.mod cell_types.mod cp_fm_types.mod cp_para_env.mod base_hooks.mod kinds.mod cp_array_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmm_ff_fist.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_ff_fist.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_ff_fist.F qmmm_ff_fist.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:42:08 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_ff_fist.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_ff_fist.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmm_ff_fist.mod' due to: qmmm_ff_fist.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_ff_fist.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'particle_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/particle_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod shell_potential_types.mod particle_types.mod input_section_types.mod external_potential_types.mod mathlib.mod string_utilities.mod input_constants.mod kinds.mod cp_output_handling.mod base_hooks.mod util.mod mathconstants.mod physcon.mod qmmm_ff_fist.mod cp_units.mod cp_log_handling.mod memory_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/particle_methods.F particle_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:42:09 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"particle_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' particle_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'particle_methods.mod' due to: particle_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/particle_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod shell_potential_types.mod particle_types.mod input_section_types.mod external_potential_types.mod mathlib.mod string_utilities.mod input_constants.mod kinds.mod cp_output_handling.mod base_hooks.mod util.mod mathconstants.mod physcon.mod qmmm_ff_fist.mod cp_units.mod cp_log_handling.mod memory_utilities.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'aux_basis_set.mod' due to: aux_basis_set.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'auto_basis.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/auto_basis.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod base_hooks.mod kinds.mod mathconstants.mod bibliography.mod aux_basis_set.mod orbital_pointers.mod periodic_table.mod powell.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/auto_basis.F auto_basis.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:42:13 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"auto_basis.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' auto_basis.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'auto_basis.mod' due to: auto_basis.o /build/cp2k-Q381vr/cp2k-8.1/src/auto_basis.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod base_hooks.mod kinds.mod mathconstants.mod bibliography.mod aux_basis_set.mod orbital_pointers.mod periodic_table.mod powell.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_colvar.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_colvar.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod input_section_types.mod input_val_types.mod input_keyword_types.mod base_hooks.mod kinds.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_colvar.F input_cp2k_colvar.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:42:17 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_colvar.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_colvar.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_colvar.mod' due to: input_cp2k_colvar.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_colvar.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod input_section_types.mod input_val_types.mod input_keyword_types.mod base_hooks.mod kinds.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_rsgrid.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_rsgrid.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod realspace_grid_types.mod input_section_types.mod base_hooks.mod kinds.mod string_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_rsgrid.F input_cp2k_rsgrid.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:42:20 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_rsgrid.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_rsgrid.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_rsgrid.mod' due to: input_cp2k_rsgrid.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_rsgrid.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod realspace_grid_types.mod input_section_types.mod base_hooks.mod kinds.mod string_utilities.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pw_spline_utils.mod' due to: pw_spline_utils.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_poisson.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_poisson.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod cell_types.mod multipole_types.mod dielectric_types.mod ps_implicit_types.mod input_section_types.mod dirichlet_bc_types.mod input_keyword_types.mod pw_poisson_types.mod string_utilities.mod input_constants.mod kinds.mod bibliography.mod cp_output_handling.mod base_hooks.mod dct.mod input_cp2k_rsgrid.mod cp_units.mod pw_spline_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_poisson.F input_cp2k_poisson.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:42:21 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_poisson.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_poisson.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_poisson.mod' due to: input_cp2k_poisson.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_poisson.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod cell_types.mod multipole_types.mod dielectric_types.mod ps_implicit_types.mod input_section_types.mod dirichlet_bc_types.mod input_keyword_types.mod pw_poisson_types.mod string_utilities.mod input_constants.mod kinds.mod bibliography.mod cp_output_handling.mod base_hooks.mod dct.mod input_cp2k_rsgrid.mod cp_units.mod pw_spline_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_field.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_field.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_val_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod bibliography.mod string_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_field.F input_cp2k_field.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:42:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_field.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_field.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_field.mod' due to: input_cp2k_field.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_field.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_val_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod bibliography.mod string_utilities.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_mm.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_mm.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_field_kind_types.mod input_section_types.mod input_val_types.mod input_keyword_types.mod base_hooks.mod kinds.mod input_cp2k_poisson.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod input_cp2k_field.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_mm.F input_cp2k_mm.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:42:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_mm.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_mm.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_mm.mod' due to: input_cp2k_mm.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_mm.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_field_kind_types.mod input_section_types.mod input_val_types.mod input_keyword_types.mod base_hooks.mod kinds.mod input_cp2k_poisson.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod input_cp2k_field.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_subsys.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_subsys.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod input_keyword_types.mod cell_types.mod base_hooks.mod kinds.mod physcon.mod bibliography.mod cp_units.mod input_cp2k_colvar.mod cp_output_handling.mod string_utilities.mod input_constants.mod input_cp2k_mm.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_subsys.F input_cp2k_subsys.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:42:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_subsys.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_subsys.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_subsys.mod' due to: input_cp2k_subsys.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_subsys.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod input_keyword_types.mod cell_types.mod base_hooks.mod kinds.mod physcon.mod bibliography.mod cp_units.mod input_cp2k_colvar.mod cp_output_handling.mod string_utilities.mod input_constants.mod input_cp2k_mm.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_motion_print.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_motion_print.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod input_cp2k_subsys.mod base_hooks.mod cp_output_handling.mod string_utilities.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_motion_print.F input_cp2k_motion_print.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:42:30 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_motion_print.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_motion_print.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_motion_print.mod' due to: input_cp2k_motion_print.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_motion_print.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod input_cp2k_subsys.mod base_hooks.mod cp_output_handling.mod string_utilities.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_loc.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_loc.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod kinds.mod input_cp2k_motion_print.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod input_cp2k_mm.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_loc.F input_cp2k_loc.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:42:30 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_loc.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_loc.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_loc.mod' due to: input_cp2k_loc.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_loc.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod kinds.mod input_cp2k_motion_print.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod input_cp2k_mm.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_hfx.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_hfx.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod kinds.mod input_cp2k_loc.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_hfx.F input_cp2k_hfx.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:42:31 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_hfx.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_hfx.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_hfx.mod' due to: input_cp2k_hfx.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_hfx.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod kinds.mod input_cp2k_loc.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'hfx_helpers.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/hfx_helpers.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/hfx_helpers.F hfx_helpers.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:42:32 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_helpers.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_helpers.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'hfx_helpers.mod' due to: hfx_helpers.o /build/cp2k-Q381vr/cp2k-8.1/src/hfx_helpers.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_interactions.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_interactions.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_control_types.mod external_potential_types.mod paw_proj_set_types.mod qs_kind_types.mod atomic_kind_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_output_handling.mod string_utilities.mod ao_util.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_interactions.F qs_interactions.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:42:33 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_interactions.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_interactions.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_interactions.mod' due to: qs_interactions.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_interactions.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_control_types.mod external_potential_types.mod paw_proj_set_types.mod qs_kind_types.mod atomic_kind_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_output_handling.mod string_utilities.mod ao_util.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'libint_wrapper.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/libint_wrapper.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/libint_wrapper.F libint_wrapper.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:42:36 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"libint_wrapper.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' libint_wrapper.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'libint_wrapper.mod' due to: libint_wrapper.o /build/cp2k-Q381vr/cp2k-8.1/src/libint_wrapper.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod orbital_pointers.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'libint_2c_3c.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/libint_2c_3c.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod gamma.mod mathconstants.mod libint_wrapper.mod orbital_pointers.mod input_constants.mod t_c_g0.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/libint_2c_3c.F libint_2c_3c.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:42:36 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"libint_2c_3c.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' libint_2c_3c.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'libint_2c_3c.mod' due to: libint_2c_3c.o /build/cp2k-Q381vr/cp2k-8.1/src/libint_2c_3c.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod gamma.mod mathconstants.mod libint_wrapper.mod orbital_pointers.mod input_constants.mod t_c_g0.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_integral_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_integral_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod base_hooks.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_integral_utils.F qs_integral_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:42:38 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_integral_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_integral_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_integral_utils.mod' due to: qs_integral_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_integral_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod base_hooks.mod orbital_pointers.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'hfx_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/hfx_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_tensors_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod basis_set_container_types.mod cp_control_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_loc_types.mod mathlib.mod string_utilities.mod input_constants.mod particle_methods.mod auto_basis.mod kinds.mod bibliography.mod cp_output_handling.mod input_cp2k_hfx.mod hfx_helpers.mod base_hooks.mod machine.mod qs_interactions.mod libint_wrapper.mod cp_files.mod libint_2c_3c.mod cp_units.mod cp_log_handling.mod qs_integral_utils.mod orbital_pointers.mod message_passing.mod t_c_g0.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/hfx_types.F hfx_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:42:39 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'hfx_types.mod' due to: hfx_types.o /build/cp2k-Q381vr/cp2k-8.1/src/hfx_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_tensors_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod basis_set_container_types.mod cp_control_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_loc_types.mod mathlib.mod string_utilities.mod input_constants.mod particle_methods.mod auto_basis.mod kinds.mod bibliography.mod cp_output_handling.mod input_cp2k_hfx.mod hfx_helpers.mod base_hooks.mod machine.mod qs_interactions.mod libint_wrapper.mod cp_files.mod libint_2c_3c.mod cp_units.mod cp_log_handling.mod qs_integral_utils.mod orbital_pointers.mod message_passing.mod t_c_g0.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'whittaker.mod' due to: whittaker.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_rho0_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho0_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_rho_atom_types.mod pw_types.mod base_hooks.mod kinds.mod mathconstants.mod memory_utilities.mod qs_grid_atom.mod cp_units.mod whittaker.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho0_types.F qs_rho0_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:43:00 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_rho0_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_rho0_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_rho0_types.mod' due to: qs_rho0_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho0_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_rho_atom_types.mod pw_types.mod base_hooks.mod kinds.mod mathconstants.mod memory_utilities.mod qs_grid_atom.mod cp_units.mod whittaker.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_local_rho_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_local_rho_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_rho0_types.mod qs_rho_atom_types.mod base_hooks.mod kinds.mod mathconstants.mod memory_utilities.mod qs_grid_atom.mod qs_harmonics_atom.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_local_rho_types.F qs_local_rho_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:43:02 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_local_rho_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_local_rho_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_local_rho_types.mod' due to: qs_local_rho_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_local_rho_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_rho0_types.mod qs_rho_atom_types.mod base_hooks.mod kinds.mod mathconstants.mod memory_utilities.mod qs_grid_atom.mod qs_harmonics_atom.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'wannier_states_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/wannier_states_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/wannier_states_types.F wannier_states_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:43:03 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"wannier_states_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' wannier_states_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'wannier_states_types.mod' due to: wannier_states_types.o /build/cp2k-Q381vr/cp2k-8.1/src/wannier_states_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'grid_api.mod' due to: grid_api.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'task_list_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/task_list_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod grid_api.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/task_list_types.F task_list_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:43:03 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"task_list_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' task_list_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'task_list_types.mod' due to: task_list_types.o /build/cp2k-Q381vr/cp2k-8.1/src/task_list_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod grid_api.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_fm_pool_types.mod' due to: cp_fm_pool_types.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_mo_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_types.F qs_mo_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:43:04 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_mo_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_mo_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_mo_types.mod' due to: qs_mo_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ai_moments.mod' due to: ai_moments.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'sap_kind_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/sap_kind_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod external_potential_types.mod particle_types.mod qs_kind_types.mod cell_types.mod base_hooks.mod kinds.mod util.mod ai_moments.mod orbital_pointers.mod ai_overlap.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/sap_kind_types.F sap_kind_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:43:05 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"sap_kind_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' sap_kind_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/sap_kind_types.F:299:76: 299 | REAL(KIND=dp), DIMENSION(:), POINTER :: a_nl, alpha_ppnl, hprj, set_radius_a | ^ Warning: ‘alpha_ppnl.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/sap_kind_types.F:299:76: Warning: ‘alpha_ppnl.span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/sap_kind_types.F:299:76: Warning: ‘alpha_ppnl.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/sap_kind_types.F:299:76: Warning: ‘alpha_ppnl.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/sap_kind_types.F:288:92: 288 | INTEGER, DIMENSION(:), POINTER :: la_max, la_min, npgfa, nprj_ppnl, & | ^ Warning: ‘nprj_ppnl.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/sap_kind_types.F:288:92: Warning: ‘nprj_ppnl.span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/sap_kind_types.F:288:92: Warning: ‘nprj_ppnl.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/sap_kind_types.F:288:92: Warning: ‘nprj_ppnl.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/sap_kind_types.F:300:96: 300 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: cprj, h_nl, rpgfa, sphi_a, vprj_ppnl, & | ^ Warning: ‘vprj_ppnl.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/sap_kind_types.F:300:96: Warning: ‘vprj_ppnl.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/sap_kind_types.F:300:96: Warning: ‘vprj_ppnl.span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/sap_kind_types.F:300:96: Warning: ‘vprj_ppnl.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/sap_kind_types.F:300:96: Warning: ‘vprj_ppnl.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/sap_kind_types.F:299:82: 299 | REAL(KIND=dp), DIMENSION(:), POINTER :: a_nl, alpha_ppnl, hprj, set_radius_a | ^ Warning: ‘hprj.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/sap_kind_types.F:299:82: Warning: ‘hprj.span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/sap_kind_types.F:299:82: Warning: ‘hprj.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/sap_kind_types.F:299:82: Warning: ‘hprj.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/sap_kind_types.F:285:83: 285 | maxsgf, na, nb, ncoa, ncoc, nkind, nlist, nneighbor, nnl, np, nppnl, nprjc, nseta, nsgfa, & | ^ Warning: ‘nprjc’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'sap_kind_types.mod' due to: sap_kind_types.o /build/cp2k-Q381vr/cp2k-8.1/src/sap_kind_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod external_potential_types.mod particle_types.mod qs_kind_types.mod cell_types.mod base_hooks.mod kinds.mod util.mod ai_moments.mod orbital_pointers.mod ai_overlap.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'block_p_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/block_p_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/block_p_types.F block_p_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:43:11 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"block_p_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' block_p_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'block_p_types.mod' due to: block_p_types.o /build/cp2k-Q381vr/cp2k-8.1/src/block_p_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_oce_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_oce_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 sap_kind_types.mod block_p_types.mod kinds.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_oce_types.F qs_oce_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:43:12 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_oce_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_oce_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_oce_types.mod' due to: qs_oce_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_oce_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 sap_kind_types.mod block_p_types.mod kinds.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'admm_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/admm_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_local_rho_types.mod task_list_types.mod cp_control_types.mod qs_kind_types.mod qs_mo_types.mod input_section_types.mod qs_oce_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_fm_struct.mod bibliography.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/admm_types.F admm_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:43:12 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"admm_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' admm_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'admm_types.mod' due to: admm_types.o /build/cp2k-Q381vr/cp2k-8.1/src/admm_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_local_rho_types.mod task_list_types.mod cp_control_types.mod qs_kind_types.mod qs_mo_types.mod input_section_types.mod qs_oce_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_fm_struct.mod bibliography.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'eri_mme_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_util.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_util.F eri_mme_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:43:14 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eri_mme/eri_mme_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eri_mme_util.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'eri_mme_util.mod' due to: eri_mme_util.o /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_util.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'minimax_exp_k15.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/minimax/minimax_exp_k15.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/minimax/minimax_exp_k15.F minimax_exp_k15.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:43:14 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"minimax/minimax_exp_k15.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/minimax/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' minimax_exp_k15.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'minimax_exp_k15.mod' due to: minimax_exp_k15.o /build/cp2k-Q381vr/cp2k-8.1/src/minimax/minimax_exp_k15.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'minimax_exp_k53.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/minimax/minimax_exp_k53.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/minimax/minimax_exp_k53.F minimax_exp_k53.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:43:28 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"minimax/minimax_exp_k53.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/minimax/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' minimax_exp_k53.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'minimax_exp_k53.mod' due to: minimax_exp_k53.o /build/cp2k-Q381vr/cp2k-8.1/src/minimax/minimax_exp_k53.F kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'minimax_exp.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/minimax/minimax_exp.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod cp_log_handling.mod kinds.mod minimax_exp_k15.mod minimax_exp_k53.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/minimax/minimax_exp.F minimax_exp.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:43:35 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"minimax/minimax_exp.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/minimax/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' minimax_exp.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'minimax_exp.mod' due to: minimax_exp.o /build/cp2k-Q381vr/cp2k-8.1/src/minimax/minimax_exp.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod cp_log_handling.mod kinds.mod minimax_exp_k15.mod minimax_exp_k53.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'eri_mme_gaussian.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_gaussian.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod minimax_exp.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_gaussian.F eri_mme_gaussian.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:43:35 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eri_mme/eri_mme_gaussian.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eri_mme_gaussian.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'eri_mme_gaussian.mod' due to: eri_mme_gaussian.o /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_gaussian.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod minimax_exp.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'eri_mme_lattice_summation.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_lattice_summation.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_unroll.fypp base_hooks.mod kinds.mod mathconstants.mod eri_mme_gaussian.mod orbital_pointers.mod ao_util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_lattice_summation.F eri_mme_lattice_summation.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:43:36 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eri_mme/eri_mme_lattice_summation.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eri_mme_lattice_summation.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'eri_mme_lattice_summation.mod' due to: eri_mme_lattice_summation.o /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_lattice_summation.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_unroll.fypp base_hooks.mod kinds.mod mathconstants.mod eri_mme_gaussian.mod orbital_pointers.mod ao_util.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'eri_mme_error_control.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_error_control.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod base_hooks.mod kinds.mod eri_mme_lattice_summation.mod mathconstants.mod eri_mme_gaussian.mod message_passing.mod ao_util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_error_control.F eri_mme_error_control.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:18 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eri_mme/eri_mme_error_control.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eri_mme_error_control.F90 /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_error_control.F:357:40: 357 | zet_c = zet_b - gr*(zet_b - zet_a) | ^ Warning: ‘zet_b’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_error_control.F:357:40: Warning: ‘zet_a’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'eri_mme_error_control.mod' due to: eri_mme_error_control.o /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_error_control.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod base_hooks.mod kinds.mod eri_mme_lattice_summation.mod mathconstants.mod eri_mme_gaussian.mod message_passing.mod ao_util.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'eri_mme_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod base_hooks.mod eri_mme_util.mod kinds.mod mathlib.mod eri_mme_error_control.mod eri_mme_gaussian.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_types.F eri_mme_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:19 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eri_mme/eri_mme_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eri_mme_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'eri_mme_types.mod' due to: eri_mme_types.o /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod base_hooks.mod eri_mme_util.mod kinds.mod mathlib.mod eri_mme_error_control.mod eri_mme_gaussian.mod orbital_pointers.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'eri_mme_integrate.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_integrate.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 eri_mme_types.mod base_hooks.mod kinds.mod eri_mme_lattice_summation.mod mathconstants.mod eri_mme_gaussian.mod orbital_pointers.mod ao_util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_integrate.F eri_mme_integrate.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:20 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eri_mme/eri_mme_integrate.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eri_mme_integrate.F90 /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_integrate.F:718:39: 718 | /vol*mone_lb | ^ Warning: ‘s_g_0.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_integrate.F:332:65: 332 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :) :: S_G_0 | ^ note: ‘s_g_0.dim[1].stride’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_integrate.F:718:39: 718 | /vol*mone_lb | ^ Warning: ‘s_g_0.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_integrate.F:332:65: 332 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :) :: S_G_0 | ^ note: ‘s_g_0.offset’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_integrate.F:93:63: 93 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :) :: S_G | ^ Warning: ‘s_g.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_integrate.F:93:63: Warning: ‘s_g.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'eri_mme_integrate.mod' due to: eri_mme_integrate.o /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_integrate.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 eri_mme_types.mod base_hooks.mod kinds.mod eri_mme_lattice_summation.mod mathconstants.mod eri_mme_gaussian.mod orbital_pointers.mod ao_util.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'eri_mme_test.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_test.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod eri_mme_types.mod base_hooks.mod kinds.mod mathconstants.mod eri_mme_gaussian.mod orbital_pointers.mod message_passing.mod eri_mme_integrate.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_test.F eri_mme_test.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eri_mme/eri_mme_test.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eri_mme_test.F90 /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_test.F:78:73: 78 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :, :) :: I_diff, I_ref, I_test | ^ Warning: ‘i_ref.dim[3].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_test.F:78:73: Warning: ‘i_ref.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_test.F:78:73: Warning: ‘i_ref.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_test.F:78:73: Warning: ‘i_ref.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'eri_mme_test.mod' due to: eri_mme_test.o /build/cp2k-Q381vr/cp2k-8.1/src/eri_mme/eri_mme_test.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod eri_mme_types.mod base_hooks.mod kinds.mod mathconstants.mod eri_mme_gaussian.mod orbital_pointers.mod message_passing.mod eri_mme_integrate.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_eri_mme_interface.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/cp_eri_mme_interface.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod input_val_types.mod input_keyword_types.mod qs_kind_types.mod input_section_types.mod cell_types.mod eri_mme_types.mod base_hooks.mod cp_log_handling.mod eri_mme_test.mod kinds.mod cp_output_handling.mod orbital_pointers.mod string_utilities.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/cp_eri_mme_interface.F cp_eri_mme_interface.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:25 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_eri_mme_interface.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_eri_mme_interface.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_eri_mme_interface.mod' due to: cp_eri_mme_interface.o /build/cp2k-Q381vr/cp2k-8.1/src/cp_eri_mme_interface.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod input_val_types.mod input_keyword_types.mod qs_kind_types.mod input_section_types.mod cell_types.mod eri_mme_types.mod base_hooks.mod cp_log_handling.mod eri_mme_test.mod kinds.mod cp_output_handling.mod orbital_pointers.mod string_utilities.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mp2_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mp2_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_eri_mme_interface.mod libint_2c_3c.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mp2_types.F mp2_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:28 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mp2_types.mod' due to: mp2_types.o /build/cp2k-Q381vr/cp2k-8.1/src/mp2_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_eri_mme_interface.mod libint_2c_3c.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'preconditioner_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/preconditioner_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_types.mod cp_para_env.mod base_hooks.mod kinds.mod cp_blacs_env.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/preconditioner_types.F preconditioner_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:30 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"preconditioner_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' preconditioner_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'preconditioner_types.mod' due to: preconditioner_types.o /build/cp2k-Q381vr/cp2k-8.1/src/preconditioner_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_types.mod cp_para_env.mod base_hooks.mod kinds.mod cp_blacs_env.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_ot_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_ot_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod preconditioner_types.mod input_section_types.mod cp_para_env.mod base_hooks.mod kinds.mod cp_fm_struct.mod cp_blacs_env.mod bibliography.mod input_constants.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_ot_types.F qs_ot_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:30 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ot_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ot_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_ot_types.mod' due to: qs_ot_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_ot_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod preconditioner_types.mod input_section_types.mod cp_para_env.mod base_hooks.mod kinds.mod cp_fm_struct.mod cp_blacs_env.mod bibliography.mod input_constants.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_block_davidson_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_block_davidson_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_fm_struct.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_block_davidson_types.F qs_block_davidson_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:32 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_block_davidson_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_block_davidson_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_block_davidson_types.mod' due to: qs_block_davidson_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_block_davidson_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_fm_struct.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_diis_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_diis_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod kinds.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_diis_types.F qs_diis_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:32 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_diis_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_diis_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_diis_types.F:84:30: 84 | SUBROUTINE qs_diis_b_retain(diis_buffer) | ^ Warning: ‘qs_diis_b_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_diis_types.mod' due to: qs_diis_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_diis_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod kinds.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_fb_trial_fns_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_trial_fns_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_trial_fns_types.F qs_fb_trial_fns_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:33 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_trial_fns_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_trial_fns_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_trial_fns_types.F:166:31: 166 | SUBROUTINE fb_trial_fns_init(trial_fns) | ^ Warning: ‘fb_trial_fns_init’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_fb_trial_fns_types.mod' due to: qs_fb_trial_fns_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_trial_fns_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_fb_atomic_halo_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_atomic_halo_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod util.mod memory_utilities.mod cp_output_handling.mod string_utilities.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_atomic_halo_types.F qs_fb_atomic_halo_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:33 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_atomic_halo_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_atomic_halo_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_atomic_halo_types.F:140:35: 140 | SUBROUTINE fb_atomic_halo_retain(atomic_halo) | ^ Warning: ‘fb_atomic_halo_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_atomic_halo_types.F:200:38: 200 | SUBROUTINE fb_atomic_halo_associate(a, b) | ^ Warning: ‘fb_atomic_halo_associate’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_atomic_halo_types.F:663:38: 663 | SUBROUTINE fb_atomic_halo_list_init(atomic_halos) | ^ Warning: ‘fb_atomic_halo_list_init’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_atomic_halo_types.F:745:39: 745 | SUBROUTINE fb_atomic_halo_list_write(atomic_halos, para_env, fb_section) | ^ Warning: ‘fb_atomic_halo_list_write’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_fb_atomic_halo_types.mod' due to: qs_fb_atomic_halo_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_atomic_halo_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod util.mod memory_utilities.mod cp_output_handling.mod string_utilities.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_fb_env_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_env_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_fb_trial_fns_types.mod qs_fb_atomic_halo_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_env_types.F qs_fb_env_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:35 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_env_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_env_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_env_types.F:101:27: 101 | SUBROUTINE fb_env_retain(fb_env) | ^ Warning: ‘fb_env_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_env_types.F:160:30: 160 | SUBROUTINE fb_env_associate(a, b) | ^ Warning: ‘fb_env_associate’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_env_types.F:213:25: 213 | SUBROUTINE fb_env_init(fb_env) | ^ Warning: ‘fb_env_init’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_fb_env_types.mod' due to: qs_fb_env_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_env_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_fb_trial_fns_types.mod qs_fb_atomic_halo_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_fm_vect.mod' due to: cp_fm_vect.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_scf_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ot_types.mod qs_density_mixing_types.mod qs_block_davidson_types.mod preconditioner_types.mod qs_diis_types.mod outer_scf_control_types.mod qs_fb_env_types.mod input_section_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_fm_vect.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_types.F qs_scf_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:36 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_scf_types.mod' due to: qs_scf_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ot_types.mod qs_density_mixing_types.mod qs_block_davidson_types.mod preconditioner_types.mod qs_diis_types.mod outer_scf_control_types.mod qs_fb_env_types.mod input_section_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_fm_vect.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'transport_env_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/transport_env_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/transport_env_types.F transport_env_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:37 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"transport_env_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' transport_env_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'transport_env_types.mod' due to: transport_env_types.o /build/cp2k-Q381vr/cp2k-8.1/src/transport_env_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_force_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_force_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod atomic_kind_types.mod base_hooks.mod kinds.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_force_types.F qs_force_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:38 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_force_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_force_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_force_types.mod' due to: qs_force_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_force_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod atomic_kind_types.mod base_hooks.mod kinds.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_kpoints.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_kpoints.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_val_types.mod input_section_types.mod base_hooks.mod kinds.mod bibliography.mod string_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_kpoints.F input_cp2k_kpoints.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:46 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_kpoints.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_kpoints.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_kpoints.mod' due to: input_cp2k_kpoints.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_kpoints.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_val_types.mod input_section_types.mod base_hooks.mod kinds.mod bibliography.mod string_utilities.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_matrix_pools.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_matrix_pools.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_pool_types.mod qs_mo_types.mod base_hooks.mod cp_fm_struct.mod cp_blacs_env.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_matrix_pools.F qs_matrix_pools.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:46 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_matrix_pools.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_matrix_pools.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_matrix_pools.mod' due to: qs_matrix_pools.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_matrix_pools.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_pool_types.mod qs_mo_types.mod base_hooks.mod cp_fm_struct.mod cp_blacs_env.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'kpoint_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_neighbor_list_types.mod qs_mo_types.mod input_section_types.mod cp_fm_types.mod cp_para_env.mod base_hooks.mod input_cp2k_kpoints.mod cp_log_handling.mod kinds.mod qs_matrix_pools.mod mathconstants.mod physcon.mod cp_blacs_env.mod cp_output_handling.mod string_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_types.F kpoint_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:48 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kpoint_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kpoint_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_types.F:418:29: 418 | SUBROUTINE set_kpoint_info(kpoint, kp_scheme, nkp_grid, kp_shift, symmetry, verbose, & | ^ Warning: ‘set_kpoint_info’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'kpoint_types.mod' due to: kpoint_types.o /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_neighbor_list_types.mod qs_mo_types.mod input_section_types.mod cp_fm_types.mod cp_para_env.mod base_hooks.mod input_cp2k_kpoints.mod cp_log_handling.mod kinds.mod qs_matrix_pools.mod mathconstants.mod physcon.mod cp_blacs_env.mod cp_output_handling.mod string_utilities.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'kpoint_transitional.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_transitional.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_dbcsr_operations.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_transitional.F kpoint_transitional.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:49 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kpoint_transitional.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kpoint_transitional.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'kpoint_transitional.mod' due to: kpoint_transitional.o /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_transitional.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_dbcsr_operations.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_rho_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_types.mod base_hooks.mod kinds.mod kpoint_transitional.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho_types.F qs_rho_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_rho_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_rho_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_rho_types.mod' due to: qs_rho_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_types.mod base_hooks.mod kinds.mod kpoint_transitional.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_subsys_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_subsys_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod molecule_kind_list_types.mod qs_kind_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod multipole_types.mod qs_force_types.mod cp_result_types.mod virial_types.mod atomic_kind_list_types.mod qs_energy_types.mod atprop_types.mod particle_types.mod molecule_types.mod molecule_list_types.mod cp_subsys_types.mod cp_para_types.mod distribution_1d_types.mod particle_list_types.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_subsys_types.F qs_subsys_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_subsys_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_subsys_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_subsys_types.mod' due to: qs_subsys_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_subsys_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod molecule_kind_list_types.mod qs_kind_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod multipole_types.mod qs_force_types.mod cp_result_types.mod virial_types.mod atomic_kind_list_types.mod qs_energy_types.mod atprop_types.mod particle_types.mod molecule_types.mod molecule_list_types.mod cp_subsys_types.mod cp_para_types.mod distribution_1d_types.mod particle_list_types.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'gaussian_gridlevels.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw_env/gaussian_gridlevels.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_log_handling.mod cp_output_handling.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw_env/gaussian_gridlevels.F gaussian_gridlevels.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:52 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw_env/gaussian_gridlevels.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw_env/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' gaussian_gridlevels.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'gaussian_gridlevels.mod' due to: gaussian_gridlevels.o /build/cp2k-Q381vr/cp2k-8.1/src/pw_env/gaussian_gridlevels.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_log_handling.mod cp_output_handling.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pw_env_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw_env/pw_env_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod pw_poisson_types.mod realspace_grid_types.mod input_section_types.mod base_hooks.mod kinds.mod gaussian_gridlevels.mod cube_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw_env/pw_env_types.F pw_env_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:52 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw_env/pw_env_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw_env/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_env_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pw_env_types.mod' due to: pw_env_types.o /build/cp2k-Q381vr/cp2k-8.1/src/pw_env/pw_env_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod pw_poisson_types.mod realspace_grid_types.mod input_section_types.mod base_hooks.mod kinds.mod gaussian_gridlevels.mod cube_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'admm_dm_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/admm_dm_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod base_hooks.mod kinds.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/admm_dm_types.F admm_dm_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:53 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"admm_dm_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' admm_dm_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'admm_dm_types.mod' due to: admm_dm_types.o /build/cp2k-Q381vr/cp2k-8.1/src/admm_dm_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod base_hooks.mod kinds.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_ks_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod pw_types.mod qs_force_types.mod cp_result_types.mod cp_control_types.mod virial_types.mod distribution_2d_types.mod qs_energy_types.mod kpoint_types.mod atprop_types.mod qs_rho_types.mod task_list_types.mod qs_subsys_types.mod particle_types.mod molecule_types.mod cp_subsys_types.mod cp_para_types.mod qs_neighbor_list_types.mod pw_env_types.mod distribution_1d_types.mod admm_dm_types.mod cp_blacs_env.mod kpoint_transitional.mod cp_para_env.mod base_hooks.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_types.F qs_ks_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:53 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ks_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ks_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_ks_types.mod' due to: qs_ks_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod pw_types.mod qs_force_types.mod cp_result_types.mod cp_control_types.mod virial_types.mod distribution_2d_types.mod qs_energy_types.mod kpoint_types.mod atprop_types.mod qs_rho_types.mod task_list_types.mod qs_subsys_types.mod particle_types.mod molecule_types.mod cp_subsys_types.mod cp_para_types.mod qs_neighbor_list_types.mod pw_env_types.mod distribution_1d_types.mod admm_dm_types.mod cp_blacs_env.mod kpoint_transitional.mod cp_para_env.mod base_hooks.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_o3c_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_o3c_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_o3c_types.F qs_o3c_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:56 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_o3c_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_o3c_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_o3c_types.mod' due to: qs_o3c_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_o3c_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'lri_environment_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/lri_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod qs_o3c_types.mod atomic_kind_types.mod base_hooks.mod kinds.mod mathlib.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/lri_environment_types.F lri_environment_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:47:57 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_environment_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_environment_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'lri_environment_types.mod' due to: lri_environment_types.o /build/cp2k-Q381vr/cp2k-8.1/src/lri_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod qs_o3c_types.mod atomic_kind_types.mod base_hooks.mod kinds.mod mathlib.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'exclusion_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/exclusion_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/exclusion_types.F exclusion_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:01 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"exclusion_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' exclusion_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'exclusion_types.mod' due to: exclusion_types.o /build/cp2k-Q381vr/cp2k-8.1/src/exclusion_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fist_neighbor_list_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fist_neighbor_list_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 exclusion_types.mod cell_types.mod base_hooks.mod kinds.mod memory_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fist_neighbor_list_types.F fist_neighbor_list_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:01 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_neighbor_list_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_neighbor_list_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fist_neighbor_list_types.mod' due to: fist_neighbor_list_types.o /build/cp2k-Q381vr/cp2k-8.1/src/fist_neighbor_list_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 exclusion_types.mod cell_types.mod base_hooks.mod kinds.mod memory_utilities.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fist_nonbond_env_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fist_nonbond_env_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod fist_neighbor_list_types.mod pair_potential_types.mod cell_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fist_nonbond_env_types.F fist_nonbond_env_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:02 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_nonbond_env_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_nonbond_env_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fist_nonbond_env_types.mod' due to: fist_nonbond_env_types.o /build/cp2k-Q381vr/cp2k-8.1/src/fist_nonbond_env_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod fist_neighbor_list_types.mod pair_potential_types.mod cell_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_mom_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_mom_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_val_types.mod input_section_types.mod base_hooks.mod input_constants.mod bibliography.mod string_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_mom_types.F qs_mom_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:03 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_mom_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_mom_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_mom_types.mod' due to: qs_mom_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_mom_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_val_types.mod input_section_types.mod base_hooks.mod input_constants.mod bibliography.mod string_utilities.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_spline_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw_env/cp_spline_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod input_section_types.mod pw_types.mod base_hooks.mod kinds.mod pw_methods.mod pw_spline_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw_env/cp_spline_utils.F cp_spline_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:04 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw_env/cp_spline_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw_env/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_spline_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_spline_utils.mod' due to: cp_spline_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/pw_env/cp_spline_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod input_section_types.mod pw_types.mod base_hooks.mod kinds.mod pw_methods.mod pw_spline_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_external.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_external.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_val_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod bibliography.mod string_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_external.F input_cp2k_external.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:04 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_external.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_external.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_external.mod' due to: input_cp2k_external.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_external.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_val_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod bibliography.mod string_utilities.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_mp2.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_mp2.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod input_keyword_types.mod input_cp2k_hfx.mod base_hooks.mod kinds.mod cp_eri_mme_interface.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_mp2.F input_cp2k_mp2.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:05 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_mp2.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_mp2.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_mp2.mod' due to: input_cp2k_mp2.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_mp2.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod input_keyword_types.mod input_cp2k_hfx.mod base_hooks.mod kinds.mod cp_eri_mme_interface.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_input_constants.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_input_constants.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_input_constants.F xc_input_constants.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:08 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_input_constants.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_input_constants.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_input_constants.mod' due to: xc_input_constants.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_input_constants.F true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_xc.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_xc.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_cp2k_hfx.mod base_hooks.mod kinds.mod input_cp2k_mp2.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod xc_input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_xc.F input_cp2k_xc.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:08 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_xc.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_xc.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_xc.mod' due to: input_cp2k_xc.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_xc.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_cp2k_hfx.mod base_hooks.mod kinds.mod input_cp2k_mp2.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod xc_input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_tb.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_tb.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod kinds.mod bibliography.mod string_utilities.mod input_constants.mod input_cp2k_mm.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_tb.F input_cp2k_tb.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:12 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_tb.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_tb.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_tb.mod' due to: input_cp2k_tb.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_tb.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod kinds.mod bibliography.mod string_utilities.mod input_constants.mod input_cp2k_mm.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_almo.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_almo.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod base_hooks.mod kinds.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_almo.F input_cp2k_almo.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:13 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_almo.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_almo.F90 /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_almo.F:684:55: 684 | optimizer_type .EQ. optimizer_lin_eq_pcg .OR. & | ^ Warning: ‘optimizer_type’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_almo.mod' due to: input_cp2k_almo.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_almo.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod base_hooks.mod kinds.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_transport.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_transport.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod input_keyword_types.mod base_hooks.mod kinds.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_transport.F input_cp2k_transport.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:14 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_transport.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_transport.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_transport.mod' due to: input_cp2k_transport.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_transport.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod input_keyword_types.mod base_hooks.mod kinds.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_ec.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_ec.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod kinds.mod bibliography.mod string_utilities.mod input_constants.mod input_cp2k_xc.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_ec.F input_cp2k_ec.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:15 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_ec.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_ec.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_ec.mod' due to: input_cp2k_ec.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_ec.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod kinds.mod bibliography.mod string_utilities.mod input_constants.mod input_cp2k_xc.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_fb_input.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_input.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_keyword_types.mod input_val_types.mod base_hooks.mod kinds.mod bibliography.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_input.F qs_fb_input.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:17 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_input.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_input.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_fb_input.mod' due to: qs_fb_input.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_input.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_keyword_types.mod input_val_types.mod base_hooks.mod kinds.mod bibliography.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pao_input.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pao_input.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pao_types.mod input_keyword_types.mod input_val_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod bibliography.mod cp_output_handling.mod string_utilities.mod linesearch.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pao_input.F pao_input.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:17 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_input.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_input.F90 /build/cp2k-Q381vr/cp2k-8.1/src/pao_input.F:232:31: 232 | s = "GAUSSIAN_PROCESS" | 1 Warning: CHARACTER expression will be truncated in assignment (10/16) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/pao_input.F:234:29: 234 | s = "NEURAL_NETWORK" | 1 Warning: CHARACTER expression will be truncated in assignment (10/14) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pao_input.mod' due to: pao_input.o /build/cp2k-Q381vr/cp2k-8.1/src/pao_input.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pao_types.mod input_keyword_types.mod input_val_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod bibliography.mod cp_output_handling.mod string_utilities.mod linesearch.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_ls.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_ls.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod qs_density_mixing_types.mod input_keyword_types.mod base_hooks.mod kinds.mod bibliography.mod cp_output_handling.mod pao_input.mod string_utilities.mod input_constants.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_ls.F input_cp2k_ls.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:19 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_ls.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_ls.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_ls.mod' due to: input_cp2k_ls.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_ls.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod qs_density_mixing_types.mod input_keyword_types.mod base_hooks.mod kinds.mod bibliography.mod cp_output_handling.mod pao_input.mod string_utilities.mod input_constants.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_distribution.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_distribution.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod base_hooks.mod string_utilities.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_distribution.F input_cp2k_distribution.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:21 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_distribution.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_distribution.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_distribution.mod' due to: input_cp2k_distribution.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_distribution.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod base_hooks.mod string_utilities.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_dft.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_dft.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod basis_set_types.mod input_section_types.mod qs_mom_types.mod qs_density_mixing_types.mod input_keyword_types.mod cp_spline_utils.mod string_utilities.mod input_cp2k_external.mod input_constants.mod input_cp2k_xc.mod kinds.mod input_cp2k_poisson.mod bibliography.mod cp_output_handling.mod base_hooks.mod input_cp2k_kpoints.mod input_cp2k_tb.mod input_cp2k_rsgrid.mod input_cp2k_almo.mod input_cp2k_transport.mod input_cp2k_mm.mod cp_units.mod input_cp2k_ec.mod input_cp2k_motion_print.mod qs_fb_input.mod input_cp2k_ls.mod input_cp2k_distribution.mod pw_spline_utils.mod input_cp2k_field.mod pw_grids.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_dft.F input_cp2k_dft.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:22 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_dft.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_dft.F90 /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_dft.F:6455:34: 6455 | SUBROUTINE create_rigpw_section(section) | ^ Warning: ‘create_rigpw_section’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_dft.mod' due to: input_cp2k_dft.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_dft.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod basis_set_types.mod input_section_types.mod qs_mom_types.mod qs_density_mixing_types.mod input_keyword_types.mod cp_spline_utils.mod string_utilities.mod input_cp2k_external.mod input_constants.mod input_cp2k_xc.mod kinds.mod input_cp2k_poisson.mod bibliography.mod cp_output_handling.mod base_hooks.mod input_cp2k_kpoints.mod input_cp2k_tb.mod input_cp2k_rsgrid.mod input_cp2k_almo.mod input_cp2k_transport.mod input_cp2k_mm.mod cp_units.mod input_cp2k_ec.mod input_cp2k_motion_print.mod qs_fb_input.mod input_cp2k_ls.mod input_cp2k_distribution.mod pw_spline_utils.mod input_cp2k_field.mod pw_grids.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'scf_control_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/scf_control_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ot_types.mod input_section_types.mod input_keyword_types.mod input_enumeration_types.mod outer_scf_control_types.mod qs_cdft_opt_types.mod base_hooks.mod cp_log_handling.mod input_cp2k_dft.mod kinds.mod cp_output_handling.mod input_constants.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/scf_control_types.F scf_control_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:40 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"scf_control_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' scf_control_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'scf_control_types.mod' due to: scf_control_types.o /build/cp2k-Q381vr/cp2k-8.1/src/scf_control_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ot_types.mod input_section_types.mod input_keyword_types.mod input_enumeration_types.mod outer_scf_control_types.mod qs_cdft_opt_types.mod base_hooks.mod cp_log_handling.mod input_cp2k_dft.mod kinds.mod cp_output_handling.mod input_constants.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xas_env_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xas_env_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_loc_types.mod scf_control_types.mod cp_fm_pool_types.mod qs_scf_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_array_utils.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xas_env_types.F xas_env_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:41 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_env_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_env_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xas_env_types.mod' due to: xas_env_types.o /build/cp2k-Q381vr/cp2k-8.1/src/xas_env_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_loc_types.mod scf_control_types.mod cp_fm_pool_types.mod qs_scf_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_array_utils.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_charges_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_charges_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_charges_types.F qs_charges_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:42 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_charges_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_charges_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_charges_types.mod' due to: qs_charges_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_charges_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rel_control_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/rel_control_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/rel_control_types.F rel_control_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:43 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rel_control_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rel_control_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rel_control_types.mod' due to: rel_control_types.o /build/cp2k-Q381vr/cp2k-8.1/src/rel_control_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_active_space_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_mo_types.mod cp_fm_types.mod base_hooks.mod kinds.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_types.F qs_active_space_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:43 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_active_space_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_active_space_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_active_space_types.mod' due to: qs_active_space_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_mo_types.mod cp_fm_types.mod base_hooks.mod kinds.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rt_propagation_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/rt_propagation_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod cp_control_types.mod qs_mo_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_fm_struct.mod qs_matrix_pools.mod bibliography.mod cp_fm_vect.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/rt_propagation_types.F rt_propagation_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:44 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rt_propagation_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_propagation_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rt_propagation_types.mod' due to: rt_propagation_types.o /build/cp2k-Q381vr/cp2k-8.1/src/rt_propagation_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod cp_control_types.mod qs_mo_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_fm_struct.mod qs_matrix_pools.mod bibliography.mod cp_fm_vect.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'hfx_compression_core_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/hfxbase/hfx_compression_core_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/hfxbase/hfx_compression_core_methods.F hfx_compression_core_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:48:46 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfxbase/hfx_compression_core_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/hfxbase/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_compression_core_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/hfxbase/hfx_compression_core_methods.F:67:23: 67 | SUBROUTINE ints2ints(Ndata, packed_data, full_data) | ^ Warning: ‘ints2ints’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'hfx_compression_core_methods.mod' due to: hfx_compression_core_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/hfxbase/hfx_compression_core_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'hfx_compression_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/hfx_compression_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod base_hooks.mod kinds.mod cp_files.mod hfx_compression_core_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/hfx_compression_methods.F hfx_compression_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:49:30 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_compression_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_compression_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'hfx_compression_methods.mod' due to: hfx_compression_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/hfx_compression_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod base_hooks.mod kinds.mod cp_files.mod hfx_compression_core_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'semi_empirical_store_int_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_store_int_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod input_section_types.mod base_hooks.mod kinds.mod memory_utilities.mod hfx_compression_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_store_int_types.F semi_empirical_store_int_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:49:31 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_store_int_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_store_int_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'semi_empirical_store_int_types.mod' due to: semi_empirical_store_int_types.o /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_store_int_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod input_section_types.mod base_hooks.mod kinds.mod memory_utilities.mod hfx_compression_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_ddapc_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/cp_ddapc_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod input_section_types.mod cell_types.mod pw_types.mod base_hooks.mod cp_log_handling.mod input_constants.mod kahan_sum.mod kinds.mod mathlib.mod mathconstants.mod spherical_harmonics.mod message_passing.mod pw_spline_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/cp_ddapc_methods.F cp_ddapc_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:49:32 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_ddapc_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_ddapc_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_ddapc_methods.mod' due to: cp_ddapc_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/cp_ddapc_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod input_section_types.mod cell_types.mod pw_types.mod base_hooks.mod cp_log_handling.mod input_constants.mod kahan_sum.mod kinds.mod mathlib.mod mathconstants.mod spherical_harmonics.mod message_passing.mod pw_spline_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ewald_spline_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/ewald_spline_util.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_grid_types.mod pw_types.mod pw_pool_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_output_handling.mod pw_methods.mod message_passing.mod pw_spline_utils.mod pw_grids.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/ewald_spline_util.F ewald_spline_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:49:36 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ewald_spline_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ewald_spline_util.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ewald_spline_util.mod' due to: ewald_spline_util.o /build/cp2k-Q381vr/cp2k-8.1/src/ewald_spline_util.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_grid_types.mod pw_types.mod pw_pool_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_output_handling.mod pw_methods.mod message_passing.mod pw_spline_utils.mod pw_grids.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cell_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/cell_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod input_keyword_types.mod input_enumeration_types.mod cp_parser_types.mod cell_types.mod input_cp2k_subsys.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod mathconstants.mod cp_units.mod cp_output_handling.mod input_constants.mod cp_parser_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/cell_methods.F cell_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:49:39 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cell_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cell_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cell_methods.mod' due to: cell_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/cell_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod input_keyword_types.mod input_enumeration_types.mod cp_parser_types.mod cell_types.mod input_cp2k_subsys.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod mathconstants.mod cp_units.mod cp_output_handling.mod input_constants.mod cp_parser_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_ddapc_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/cp_ddapc_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_grid_types.mod pw_types.mod pw_pool_types.mod pw_poisson_types.mod particle_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathconstants.mod cp_output_handling.mod cp_ddapc_methods.mod ewald_spline_util.mod pw_grids.mod cell_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/cp_ddapc_types.F cp_ddapc_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:49:40 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_ddapc_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_ddapc_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_ddapc_types.mod' due to: cp_ddapc_types.o /build/cp2k-Q381vr/cp2k-8.1/src/cp_ddapc_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_grid_types.mod pw_types.mod pw_pool_types.mod pw_poisson_types.mod particle_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathconstants.mod cp_output_handling.mod cp_ddapc_methods.mod ewald_spline_util.mod pw_grids.mod cell_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_linres_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_loc_types.mod qs_rho_types.mod qs_rho_atom_types.mod qs_kind_types.mod realspace_grid_types.mod atomic_kind_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_array_utils.mod qs_grid_atom.mod qs_harmonics_atom.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_types.F qs_linres_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:49:41 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_types.F:1096:35: 1096 | SUBROUTINE deallocate_jrho_coeff(jrho1_atom_set, iatom) | ^ Warning: ‘deallocate_jrho_coeff’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_types.F:1135:27: 1135 | SUBROUTINE get_jrho_atom(jrho1_atom_set, iatom, cjc_h, cjc_s, cjc_ii_h, cjc_ii_s, & | ^ Warning: ‘get_jrho_atom’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_linres_types.mod' due to: qs_linres_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_loc_types.mod qs_rho_types.mod qs_rho_atom_types.mod qs_kind_types.mod realspace_grid_types.mod atomic_kind_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_array_utils.mod qs_grid_atom.mod qs_harmonics_atom.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_period_efield_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_period_efield_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_dbcsr_operations.mod kinds.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_period_efield_types.F qs_period_efield_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:49:49 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_period_efield_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_period_efield_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_period_efield_types.mod' due to: qs_period_efield_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_period_efield_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_dbcsr_operations.mod kinds.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_derivative_desc.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_derivative_desc.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_derivative_desc.F xc_derivative_desc.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:49:49 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_derivative_desc.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_derivative_desc.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_derivative_desc.mod' due to: xc_derivative_desc.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_derivative_desc.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_derivative_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_derivative_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod base_hooks.mod kinds.mod xc_derivative_desc.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_derivative_types.F xc_derivative_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:49:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_derivative_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_derivative_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_derivative_types.F:92:34: 92 | SUBROUTINE xc_derivative_retain(deriv) | ^ Warning: ‘xc_derivative_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_derivative_types.mod' due to: xc_derivative_types.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_derivative_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod base_hooks.mod kinds.mod xc_derivative_desc.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_linked_list_xc_deriv.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/cp_linked_list_xc_deriv.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_linked_list.fypp xc_derivative_types.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/cp_linked_list_xc_deriv.F cp_linked_list_xc_deriv.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:49:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/cp_linked_list_xc_deriv.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_linked_list_xc_deriv.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xc/cp_linked_list_xc_deriv.F:47:3: 47 | $:inst(nametype1, type1, type1in, type1out, eq, arrayeq, type1arrayEl, arrayEl, private_routines) | ^ Warning: ‘cp_sll_deriv_less_q’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_linked_list_xc_deriv.mod' due to: cp_linked_list_xc_deriv.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/cp_linked_list_xc_deriv.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/src/common/cp_linked_list.fypp xc_derivative_types.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_derivative_set_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_derivative_set_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_pool_types.mod xc_derivative_types.mod base_hooks.mod kinds.mod cp_linked_list_xc_deriv.mod message_passing.mod xc_derivative_desc.mod pw_grids.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_derivative_set_types.F xc_derivative_set_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:49:51 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_derivative_set_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_derivative_set_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_derivative_set_types.F:187:28: 187 | SUBROUTINE xc_dset_retain(deriv_set) | ^ Warning: ‘xc_dset_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_derivative_set_types.mod' due to: xc_derivative_set_types.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_derivative_set_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_pool_types.mod xc_derivative_types.mod base_hooks.mod kinds.mod cp_linked_list_xc_deriv.mod message_passing.mod xc_derivative_desc.mod pw_grids.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_rho_cflags_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_rho_cflags_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_rho_cflags_types.F xc_rho_cflags_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:49:52 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_rho_cflags_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_rho_cflags_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_rho_cflags_types.mod' due to: xc_rho_cflags_types.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_rho_cflags_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_rho_set_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_rho_set_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod pw_pool_types.mod pw_types.mod base_hooks.mod kinds.mod cp_array_utils.mod pw_methods.mod pw_spline_utils.mod xc_input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_rho_set_types.F xc_rho_set_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:49:52 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_rho_set_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_rho_set_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_rho_set_types.F:163:31: 163 | SUBROUTINE xc_rho_set_retain(rho_set) | ^ Warning: ‘xc_rho_set_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_rho_set_types.mod' due to: xc_rho_set_types.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_rho_set_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod pw_pool_types.mod pw_types.mod base_hooks.mod kinds.mod cp_array_utils.mod pw_methods.mod pw_spline_utils.mod xc_input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_kpp1_env_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_kpp1_env_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod pw_types.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_kpp1_env_types.F qs_kpp1_env_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:49:56 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_kpp1_env_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_kpp1_env_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_kpp1_env_types.F:156:25: 156 | SUBROUTINE kpp1_retain(kpp1_env) | ^ Warning: ‘kpp1_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_kpp1_env_types.mod' due to: qs_kpp1_env_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_kpp1_env_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod pw_types.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'hartree_local_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/hartree_local_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_rho_atom_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/hartree_local_types.F hartree_local_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:49:56 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hartree_local_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hartree_local_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'hartree_local_types.mod' due to: hartree_local_types.o /build/cp2k-Q381vr/cp2k-8.1/src/hartree_local_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_rho_atom_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_p_env_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_p_env_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_local_rho_types.mod qs_rho_types.mod preconditioner_types.mod qs_kpp1_env_types.mod hartree_local_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_fm_vect.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_p_env_types.F qs_p_env_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:49:57 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_p_env_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_p_env_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_p_env_types.F:115:26: 115 | SUBROUTINE p_env_retain(p_env) | ^ Warning: ‘p_env_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_p_env_types.mod' due to: qs_p_env_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_p_env_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_local_rho_types.mod qs_rho_types.mod preconditioner_types.mod qs_kpp1_env_types.mod hartree_local_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_fm_vect.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ec_env_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/ec_env_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_force_types.mod task_list_types.mod qs_neighbor_list_types.mod qs_period_efield_types.mod qs_dispersion_types.mod qs_p_env_types.mod input_section_types.mod pw_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/ec_env_types.F ec_env_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:49:58 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ec_env_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ec_env_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ec_env_types.mod' due to: ec_env_types.o /build/cp2k-Q381vr/cp2k-8.1/src/ec_env_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_force_types.mod task_list_types.mod qs_neighbor_list_types.mod qs_period_efield_types.mod qs_dispersion_types.mod qs_p_env_types.mod input_section_types.mod pw_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mscfg_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mscfg_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mscfg_types.F mscfg_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:49:58 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mscfg_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mscfg_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mscfg_types.mod' due to: mscfg_types.o /build/cp2k-Q381vr/cp2k-8.1/src/mscfg_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_ks_qmmm_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_qmmm_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod pw_env_types.mod pw_types.mod base_hooks.mod kinds.mod cube_utils.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_qmmm_types.F qs_ks_qmmm_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:49:59 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ks_qmmm_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ks_qmmm_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_ks_qmmm_types.mod' due to: qs_ks_qmmm_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_qmmm_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod pw_env_types.mod pw_types.mod base_hooks.mod kinds.mod cube_utils.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'integration_grid_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/integration_grid_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/integration_grid_types.F integration_grid_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:00 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"integration_grid_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' integration_grid_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'integration_grid_types.mod' due to: integration_grid_types.o /build/cp2k-Q381vr/cp2k-8.1/src/integration_grid_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'kg_environment_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/kg_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 task_list_types.mod integration_grid_types.mod qs_neighbor_list_types.mod qs_dispersion_types.mod lri_environment_types.mod molecule_types.mod input_section_types.mod base_hooks.mod kinds.mod qs_grid_atom.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/kg_environment_types.F kg_environment_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:02 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kg_environment_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kg_environment_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'kg_environment_types.mod' due to: kg_environment_types.o /build/cp2k-Q381vr/cp2k-8.1/src/kg_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 task_list_types.mod integration_grid_types.mod qs_neighbor_list_types.mod qs_dispersion_types.mod lri_environment_types.mod molecule_types.mod input_section_types.mod base_hooks.mod kinds.mod qs_grid_atom.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_gcp_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_gcp_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_gcp_types.F qs_gcp_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:03 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_gcp_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_gcp_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_gcp_types.mod' due to: qs_gcp_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_gcp_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'et_coupling_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/et_coupling_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod kinds.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/et_coupling_types.F et_coupling_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:03 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"et_coupling_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' et_coupling_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/et_coupling_types.F:74:34: 74 | SUBROUTINE get_et_coupling_type(et_coupling, et_mo_coeff, rest_mat) | ^ Warning: ‘get_et_coupling_type’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'et_coupling_types.mod' due to: et_coupling_types.o /build/cp2k-Q381vr/cp2k-8.1/src/et_coupling_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod kinds.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ewald_environment_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/ewald_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_keyword_types.mod pw_poisson_types.mod input_enumeration_types.mod input_section_types.mod cp_para_env.mod base_hooks.mod cp_log_handling.mod kinds.mod mathconstants.mod input_cp2k_poisson.mod cp_output_handling.mod pw_grid_info.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/ewald_environment_types.F ewald_environment_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:03 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ewald_environment_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ewald_environment_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ewald_environment_types.mod' due to: ewald_environment_types.o /build/cp2k-Q381vr/cp2k-8.1/src/ewald_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_keyword_types.mod pw_poisson_types.mod input_enumeration_types.mod input_section_types.mod cp_para_env.mod base_hooks.mod cp_log_handling.mod kinds.mod mathconstants.mod input_cp2k_poisson.mod cp_output_handling.mod pw_grid_info.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_wf_history_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_wf_history_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_wf_history_types.F qs_wf_history_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:05 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_wf_history_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_wf_history_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_wf_history_types.mod' due to: qs_wf_history_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_wf_history_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmm_gaussian_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gaussian_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gaussian_types.F qmmm_gaussian_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:06 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_gaussian_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_gaussian_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmm_gaussian_types.mod' due to: qmmm_gaussian_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gaussian_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'force_field_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/force_field_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 damping_dipole_types.mod force_field_kind_types.mod shell_potential_types.mod pair_potential_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/force_field_types.F force_field_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:06 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_field_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_field_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'force_field_types.mod' due to: force_field_types.o /build/cp2k-Q381vr/cp2k-8.1/src/force_field_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 damping_dipole_types.mod force_field_kind_types.mod shell_potential_types.mod pair_potential_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'dgs.mod' due to: dgs.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pw_poisson_methods.mod' due to: pw_poisson_methods.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pw_poisson_read_input.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw_poisson_read_input.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dirichlet_bc_types.mod pw_poisson_types.mod ps_wavelet_types.mod input_section_types.mod cell_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw_poisson_read_input.F pw_poisson_read_input.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:07 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw_poisson_read_input.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_poisson_read_input.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pw_poisson_read_input.mod' due to: pw_poisson_read_input.o /build/cp2k-Q381vr/cp2k-8.1/src/pw_poisson_read_input.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dirichlet_bc_types.mod pw_poisson_types.mod ps_wavelet_types.mod input_section_types.mod cell_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_realspace_grid_init.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/cp_realspace_grid_init.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod input_section_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/cp_realspace_grid_init.F cp_realspace_grid_init.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:10 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_realspace_grid_init.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_realspace_grid_init.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_realspace_grid_init.mod' due to: cp_realspace_grid_init.o /build/cp2k-Q381vr/cp2k-8.1/src/cp_realspace_grid_init.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod input_section_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ewald_pw_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/ewald_pw_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod cell_types.mod realspace_grid_types.mod dg_types.mod input_section_types.mod ewald_environment_types.mod cp_para_types.mod pw_pool_types.mod pw_poisson_types.mod dgs.mod pw_poisson_methods.mod kinds.mod cp_output_handling.mod base_hooks.mod mathconstants.mod pw_poisson_read_input.mod ao_util.mod cp_log_handling.mod message_passing.mod cp_realspace_grid_init.mod pw_grids.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/ewald_pw_types.F ewald_pw_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:11 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ewald_pw_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ewald_pw_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ewald_pw_types.mod' due to: ewald_pw_types.o /build/cp2k-Q381vr/cp2k-8.1/src/ewald_pw_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod cell_types.mod realspace_grid_types.mod dg_types.mod input_section_types.mod ewald_environment_types.mod cp_para_types.mod pw_pool_types.mod pw_poisson_types.mod dgs.mod pw_poisson_methods.mod kinds.mod cp_output_handling.mod base_hooks.mod mathconstants.mod pw_poisson_read_input.mod ao_util.mod cp_log_handling.mod message_passing.mod cp_realspace_grid_init.mod pw_grids.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmm_types_low.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_types_low.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_gaussian_types.mod pw_grid_types.mod pw_types.mod pw_pool_types.mod force_field_types.mod ewald_pw_types.mod particle_types.mod ewald_environment_types.mod base_hooks.mod kinds.mod cp_eri_mme_interface.mod input_constants.mod pw_grids.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_types_low.F qmmm_types_low.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:12 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_types_low.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_types_low.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmm_types_low.mod' due to: qmmm_types_low.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_types_low.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_gaussian_types.mod pw_grid_types.mod pw_types.mod pw_pool_types.mod force_field_types.mod ewald_pw_types.mod particle_types.mod ewald_environment_types.mod base_hooks.mod kinds.mod cp_eri_mme_interface.mod input_constants.mod pw_grids.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_environment_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 almo_scf_types.mod dm_ls_scf_types.mod semi_empirical_types.mod hfx_types.mod qs_local_rho_types.mod wannier_states_types.mod admm_types.mod mp2_types.mod qs_scf_types.mod transport_env_types.mod qs_kind_types.mod qs_ks_types.mod lri_environment_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod global_types.mod pw_types.mod cp_fm_types.mod fist_nonbond_env_types.mod qs_force_types.mod xas_env_types.mod cp_result_types.mod cp_control_types.mod qs_charges_types.mod rel_control_types.mod qs_active_space_types.mod virial_types.mod rt_propagation_types.mod distribution_2d_types.mod semi_empirical_store_int_types.mod cp_ddapc_types.mod semi_empirical_mpole_types.mod qs_energy_types.mod kpoint_types.mod qs_linres_types.mod atprop_types.mod ec_env_types.mod qs_rho_types.mod task_list_types.mod mscfg_types.mod qs_ks_qmmm_types.mod kg_environment_types.mod particle_types.mod qs_dftb_types.mod qs_gcp_types.mod qs_mo_types.mod qs_period_efield_types.mod qs_rho_atom_types.mod qs_subsys_types.mod et_coupling_types.mod molecule_types.mod qs_dispersion_types.mod input_section_types.mod ewald_environment_types.mod qs_wf_history_types.mod scf_control_types.mod cp_subsys_types.mod cp_para_types.mod qs_rho0_types.mod qmmm_types_low.mod qs_neighbor_list_types.mod pw_env_types.mod distribution_1d_types.mod ewald_pw_types.mod admm_dm_types.mod hartree_local_types.mod qs_oce_types.mod qs_matrix_pools.mod input_constants.mod kinds.mod cp_blacs_env.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_environment_types.F qs_environment_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:13 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_environment_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_environment_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_environment_types.mod' due to: qs_environment_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 almo_scf_types.mod dm_ls_scf_types.mod semi_empirical_types.mod hfx_types.mod qs_local_rho_types.mod wannier_states_types.mod admm_types.mod mp2_types.mod qs_scf_types.mod transport_env_types.mod qs_kind_types.mod qs_ks_types.mod lri_environment_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod global_types.mod pw_types.mod cp_fm_types.mod fist_nonbond_env_types.mod qs_force_types.mod xas_env_types.mod cp_result_types.mod cp_control_types.mod qs_charges_types.mod rel_control_types.mod qs_active_space_types.mod virial_types.mod rt_propagation_types.mod distribution_2d_types.mod semi_empirical_store_int_types.mod cp_ddapc_types.mod semi_empirical_mpole_types.mod qs_energy_types.mod kpoint_types.mod qs_linres_types.mod atprop_types.mod ec_env_types.mod qs_rho_types.mod task_list_types.mod mscfg_types.mod qs_ks_qmmm_types.mod kg_environment_types.mod particle_types.mod qs_dftb_types.mod qs_gcp_types.mod qs_mo_types.mod qs_period_efield_types.mod qs_rho_atom_types.mod qs_subsys_types.mod et_coupling_types.mod molecule_types.mod qs_dispersion_types.mod input_section_types.mod ewald_environment_types.mod qs_wf_history_types.mod scf_control_types.mod cp_subsys_types.mod cp_para_types.mod qs_rho0_types.mod qmmm_types_low.mod qs_neighbor_list_types.mod pw_env_types.mod distribution_1d_types.mod ewald_pw_types.mod admm_dm_types.mod hartree_local_types.mod qs_oce_types.mod qs_matrix_pools.mod input_constants.mod kinds.mod cp_blacs_env.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fist_energy_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fist_energy_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fist_energy_types.F fist_energy_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:19 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_energy_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_energy_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fist_energy_types.mod' due to: fist_energy_types.o /build/cp2k-Q381vr/cp2k-8.1/src/fist_energy_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fist_efield_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fist_efield_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fist_efield_types.F fist_efield_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:20 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_efield_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_efield_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fist_efield_types.mod' due to: fist_efield_types.o /build/cp2k-Q381vr/cp2k-8.1/src/fist_efield_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fist_environment_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fist_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod multipole_types.mod exclusion_types.mod fist_nonbond_env_types.mod cp_result_types.mod atomic_kind_list_types.mod fist_energy_types.mod particle_types.mod molecule_types.mod input_section_types.mod ewald_environment_types.mod molecule_list_types.mod fist_efield_types.mod cp_subsys_types.mod cp_para_types.mod qmmm_types_low.mod distribution_1d_types.mod ewald_pw_types.mod particle_list_types.mod cp_para_env.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fist_environment_types.F fist_environment_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:20 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_environment_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_environment_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fist_environment_types.mod' due to: fist_environment_types.o /build/cp2k-Q381vr/cp2k-8.1/src/fist_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod multipole_types.mod exclusion_types.mod fist_nonbond_env_types.mod cp_result_types.mod atomic_kind_list_types.mod fist_energy_types.mod particle_types.mod molecule_types.mod input_section_types.mod ewald_environment_types.mod molecule_list_types.mod fist_efield_types.mod cp_subsys_types.mod cp_para_types.mod qmmm_types_low.mod distribution_1d_types.mod ewald_pw_types.mod particle_list_types.mod cp_para_env.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmm_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod cp_subsys_types.mod qs_environment_types.mod qmmm_types_low.mod fist_environment_types.mod fist_energy_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_types.F qmmm_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:21 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmm_types.mod' due to: qmmm_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod cp_subsys_types.mod qs_environment_types.mod qmmm_types_low.mod fist_environment_types.mod fist_energy_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mixed_energy_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mixed_energy_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mixed_energy_types.F mixed_energy_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mixed_energy_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mixed_energy_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mixed_energy_types.mod' due to: mixed_energy_types.o /build/cp2k-Q381vr/cp2k-8.1/src/mixed_energy_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mixed_cdft_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_cdft_types.mod pw_env_types.mod qs_kind_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_array_utils.mod cp_blacs_env.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_types.F mixed_cdft_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mixed_cdft_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mixed_cdft_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mixed_cdft_types.mod' due to: mixed_cdft_types.o /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_cdft_types.mod pw_env_types.mod qs_kind_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_array_utils.mod cp_blacs_env.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mixed_environment_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mixed_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 mixed_energy_types.mod molecule_kind_list_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod cp_result_types.mod atomic_kind_list_types.mod qs_rho_types.mod mixed_cdft_types.mod particle_types.mod molecule_types.mod input_section_types.mod molecule_list_types.mod cp_subsys_types.mod cp_para_types.mod distribution_1d_types.mod particle_list_types.mod kinds.mod cp_para_env.mod base_hooks.mod cp_log_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mixed_environment_types.F mixed_environment_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mixed_environment_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mixed_environment_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mixed_environment_types.mod' due to: mixed_environment_types.o /build/cp2k-Q381vr/cp2k-8.1/src/mixed_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 mixed_energy_types.mod molecule_kind_list_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod cp_result_types.mod atomic_kind_list_types.mod qs_rho_types.mod mixed_cdft_types.mod particle_types.mod molecule_types.mod input_section_types.mod molecule_list_types.mod cp_subsys_types.mod cp_para_types.mod distribution_1d_types.mod particle_list_types.mod kinds.mod cp_para_env.mod base_hooks.mod cp_log_handling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pwdft_environment_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pwdft_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cp_para_types.mod qs_subsys_types.mod input_section_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pwdft_environment_types.F pwdft_environment_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pwdft_environment_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pwdft_environment_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pwdft_environment_types.mod' due to: pwdft_environment_types.o /build/cp2k-Q381vr/cp2k-8.1/src/pwdft_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cp_para_types.mod qs_subsys_types.mod input_section_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fp_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fp_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_output_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fp_types.F fp_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:28 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fp_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fp_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fp_types.mod' due to: fp_types.o /build/cp2k-Q381vr/cp2k-8.1/src/fp_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_output_handling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'nnp_environment_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/nnp_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod molecule_kind_list_types.mod distribution_1d_types.mod particle_types.mod atomic_kind_list_types.mod virial_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod particle_list_types.mod molecule_list_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/nnp_environment_types.F nnp_environment_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:28 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"nnp_environment_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' nnp_environment_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'nnp_environment_types.mod' due to: nnp_environment_types.o /build/cp2k-Q381vr/cp2k-8.1/src/nnp_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod molecule_kind_list_types.mod distribution_1d_types.mod particle_types.mod atomic_kind_list_types.mod virial_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod particle_list_types.mod molecule_list_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmmx_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmmx_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod cp_subsys_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmmx_types.F qmmmx_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:31 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmmx_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmmx_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmmx_types.mod' due to: qmmmx_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmmx_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod cp_subsys_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'eip_environment_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/eip_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod molecule_kind_list_types.mod distribution_1d_types.mod particle_types.mod atomic_kind_list_types.mod virial_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod particle_list_types.mod molecule_list_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/eip_environment_types.F eip_environment_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:33 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eip_environment_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eip_environment_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'eip_environment_types.mod' due to: eip_environment_types.o /build/cp2k-Q381vr/cp2k-8.1/src/eip_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod molecule_kind_list_types.mod distribution_1d_types.mod particle_types.mod atomic_kind_list_types.mod virial_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod particle_list_types.mod molecule_list_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'embed_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/embed_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod lri_environment_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod cp_result_types.mod atomic_kind_list_types.mod particle_types.mod molecule_types.mod input_section_types.mod molecule_list_types.mod cp_subsys_types.mod cp_para_types.mod distribution_1d_types.mod particle_list_types.mod kinds.mod cp_para_env.mod base_hooks.mod cp_log_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/embed_types.F embed_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:34 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"embed_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' embed_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'embed_types.mod' due to: embed_types.o /build/cp2k-Q381vr/cp2k-8.1/src/embed_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod lri_environment_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod cp_result_types.mod atomic_kind_list_types.mod particle_types.mod molecule_types.mod input_section_types.mod molecule_list_types.mod cp_subsys_types.mod cp_para_types.mod distribution_1d_types.mod particle_list_types.mod kinds.mod cp_para_env.mod base_hooks.mod cp_log_handling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'metadynamics_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/metadynamics_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod input_section_types.mod cp_para_env.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/metadynamics_types.F metadynamics_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:35 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"metadynamics_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' metadynamics_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'metadynamics_types.mod' due to: metadynamics_types.o /build/cp2k-Q381vr/cp2k-8.1/src/metadynamics_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod input_section_types.mod cp_para_env.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'force_env_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/force_env_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod mixed_energy_types.mod mixed_environment_types.mod pwdft_environment_types.mod fp_types.mod cell_types.mod global_types.mod nnp_environment_types.mod qmmmx_types.mod fist_environment_types.mod fist_energy_types.mod qs_energy_types.mod eip_environment_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod qs_environment_types.mod embed_types.mod metadynamics_types.mod kinds.mod cp_para_env.mod base_hooks.mod cp_log_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/force_env_types.F force_env_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:36 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_env_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_env_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/force_env_types.F:702:45: 702 | i_force_eval(1) = main_force_eval | ^ Warning: ‘main_force_eval’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'force_env_types.mod' due to: force_env_types.o /build/cp2k-Q381vr/cp2k-8.1/src/force_env_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod mixed_energy_types.mod mixed_environment_types.mod pwdft_environment_types.mod fp_types.mod cell_types.mod global_types.mod nnp_environment_types.mod qmmmx_types.mod fist_environment_types.mod fist_energy_types.mod qs_energy_types.mod eip_environment_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod qs_environment_types.mod embed_types.mod metadynamics_types.mod kinds.mod cp_para_env.mod base_hooks.mod cp_log_handling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'thermal_region_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermal_region_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermal_region_types.F thermal_region_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:39 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermal_region_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' thermal_region_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'thermal_region_types.mod' due to: thermal_region_types.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermal_region_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'md_ener_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_ener_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_ener_types.F md_ener_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:39 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/md_ener_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' md_ener_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'md_ener_types.mod' due to: md_ener_types.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_ener_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rmsd.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/rmsd.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod base_hooks.mod kinds.mod mathlib.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/rmsd.F rmsd.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:40 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rmsd.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rmsd.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rmsd.mod' due to: rmsd.o /build/cp2k-Q381vr/cp2k-8.1/src/rmsd.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod base_hooks.mod kinds.mod mathlib.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'constraint_fxd.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/constraint_fxd.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod cp_subsys_types.mod force_env_types.mod molecule_kind_list_types.mod distribution_1d_types.mod particle_types.mod atomic_kind_list_types.mod atomic_kind_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod particle_list_types.mod base_hooks.mod kinds.mod util.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/constraint_fxd.F constraint_fxd.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:41 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"constraint_fxd.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' constraint_fxd.F90 /build/cp2k-Q381vr/cp2k-8.1/src/constraint_fxd.F:241:86: 241 | shell_particle_set(shell_index)%f(:) = force(:, natom + shell_index) | ^ Warning: ‘shell_particle_set.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/constraint_fxd.F:241:86: Warning: ‘shell_particle_set.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/constraint_fxd.F:241:86: Warning: ‘shell_particle_set.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/constraint_fxd.F:240:75: 240 | core_particle_set(shell_index)%f(:) = force(:, iparticle) | ^ Warning: ‘core_particle_set.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/constraint_fxd.F:240:75: Warning: ‘core_particle_set.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/constraint_fxd.F:240:75: Warning: ‘core_particle_set.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'constraint_fxd.mod' due to: constraint_fxd.o /build/cp2k-Q381vr/cp2k-8.1/src/constraint_fxd.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod cp_subsys_types.mod force_env_types.mod molecule_kind_list_types.mod distribution_1d_types.mod particle_types.mod atomic_kind_list_types.mod atomic_kind_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod particle_list_types.mod base_hooks.mod kinds.mod util.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fparser.mod' due to: fparser.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'extended_system_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/extended_system_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod bibliography.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/extended_system_types.F extended_system_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:43 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"extended_system_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' extended_system_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'extended_system_types.mod' due to: extended_system_types.o /build/cp2k-Q381vr/cp2k-8.1/src/extended_system_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod bibliography.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'topology_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/topology_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod cell_types.mod base_hooks.mod kinds.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/topology_types.F topology_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:44 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'topology_types.mod' due to: topology_types.o /build/cp2k-Q381vr/cp2k-8.1/src/topology_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod cell_types.mod base_hooks.mod kinds.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'string_table.mod' due to: string_table.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_binary_restarts.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_binary_restarts.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod extended_system_types.mod particle_types.mod topology_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod message_passing.mod cp_files.mod print_messages.mod string_table.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_binary_restarts.F input_cp2k_binary_restarts.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:45 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_binary_restarts.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_binary_restarts.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_binary_restarts.mod' due to: input_cp2k_binary_restarts.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_binary_restarts.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod extended_system_types.mod particle_types.mod topology_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod message_passing.mod cp_files.mod print_messages.mod string_table.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pair_potential_coulomb.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pair_potential_coulomb.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod mathconstants.mod kinds.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pair_potential_coulomb.F pair_potential_coulomb.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:48 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pair_potential_coulomb.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pair_potential_coulomb.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pair_potential_coulomb.mod' due to: pair_potential_coulomb.o /build/cp2k-Q381vr/cp2k-8.1/src/pair_potential_coulomb.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod mathconstants.mod kinds.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'splines_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/splines_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 splines_types.mod cp_log_handling.mod kinds.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/splines_methods.F splines_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:49 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"splines_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' splines_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'splines_methods.mod' due to: splines_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/splines_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 splines_types.mod cp_log_handling.mod kinds.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pair_potential_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pair_potential_util.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pair_potential_types.mod base_hooks.mod kinds.mod physcon.mod fparser.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pair_potential_util.F pair_potential_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:49 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pair_potential_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pair_potential_util.F90 /build/cp2k-Q381vr/cp2k-8.1/src/pair_potential_util.F:148:31: 148 | value = value + lvalue | ^ Warning: ‘pp’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pair_potential_util.mod' due to: pair_potential_util.o /build/cp2k-Q381vr/cp2k-8.1/src/pair_potential_util.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pair_potential_types.mod base_hooks.mod kinds.mod physcon.mod fparser.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pair_potential.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pair_potential.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 splines_types.mod atomic_kind_types.mod pair_potential_types.mod base_hooks.mod cp_log_handling.mod kinds.mod util.mod physcon.mod splines_methods.mod fparser.mod pair_potential_util.mod cp_files.mod string_table.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pair_potential.F pair_potential.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pair_potential.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pair_potential.F90 /build/cp2k-Q381vr/cp2k-8.1/src/pair_potential.F:1025:77: 1025 | pot%spl_f%rcutsq_f = (min_sigma6/m_sigma6)**(1.0_dp/3.0_dp) | ^ Warning: ‘min_sigma6’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pair_potential.F:943:98: 943 | REAL(KIND=dp) :: hicut0, l_epsilon, l_sigma6, m_epsilon, & | ^ Warning: ‘m_epsilon’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pair_potential.F:944:68: 944 | m_sigma6, min_sigma6, rcovi, rcovj | ^ Warning: ‘m_sigma6’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pair_potential.mod' due to: pair_potential.o /build/cp2k-Q381vr/cp2k-8.1/src/pair_potential.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 splines_types.mod atomic_kind_types.mod pair_potential_types.mod base_hooks.mod cp_log_handling.mod kinds.mod util.mod physcon.mod splines_methods.mod fparser.mod pair_potential_util.mod cp_files.mod string_table.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'atoms_input.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/atoms_input.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod shell_potential_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod topology_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod memory_utilities.mod cp_units.mod string_utilities.mod cp_linked_list_input.mod cp_parser_methods.mod string_table.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/atoms_input.F atoms_input.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:55 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atoms_input.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atoms_input.F90 /build/cp2k-Q381vr/cp2k-8.1/src/atoms_input.F:441:84: 441 | core_particle_set(sh_index)%r(:) = rc(:, ishell)*unit_conv_core | ^ Warning: ‘unit_conv_core’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'atoms_input.mod' due to: atoms_input.o /build/cp2k-Q381vr/cp2k-8.1/src/atoms_input.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod shell_potential_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod topology_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod memory_utilities.mod cp_units.mod string_utilities.mod cp_linked_list_input.mod cp_parser_methods.mod string_table.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'force_fields_all.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/force_fields_all.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod input_val_types.mod molecule_kind_types.mod cell_types.mod force_field_kind_types.mod shell_potential_types.mod splines_types.mod particle_types.mod molecule_types.mod pair_potential_types.mod input_section_types.mod ewald_environment_types.mod damping_dipole_types.mod force_field_types.mod qmmm_types_low.mod external_potential_types.mod input_cp2k_binary_restarts.mod string_utilities.mod cp_linked_list_input.mod input_constants.mod pair_potential_coulomb.mod kinds.mod base_hooks.mod pair_potential.mod mathconstants.mod physcon.mod atoms_input.mod qmmm_ff_fist.mod cp_log_handling.mod memory_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/force_fields_all.F force_fields_all.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:50:57 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_fields_all.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_fields_all.F90 /build/cp2k-Q381vr/cp2k-8.1/src/force_fields_all.F:2659:39: 2659 | rmin = rmin2_a + rmin2_b | ^ Warning: ‘rmin2_b’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/force_fields_all.F:2659:39: Warning: ‘rmin2_a’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/force_fields_all.F:2661:56: 2661 | epsilon0 = SQRT(ABS(epsilon_a*epsilon_b)) | ^ Warning: ‘epsilon_b’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/force_fields_all.F:2661:56: Warning: ‘epsilon_a’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'force_fields_all.mod' due to: force_fields_all.o /build/cp2k-Q381vr/cp2k-8.1/src/force_fields_all.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod input_val_types.mod molecule_kind_types.mod cell_types.mod force_field_kind_types.mod shell_potential_types.mod splines_types.mod particle_types.mod molecule_types.mod pair_potential_types.mod input_section_types.mod ewald_environment_types.mod damping_dipole_types.mod force_field_types.mod qmmm_types_low.mod external_potential_types.mod input_cp2k_binary_restarts.mod string_utilities.mod cp_linked_list_input.mod input_constants.mod pair_potential_coulomb.mod kinds.mod base_hooks.mod pair_potential.mod mathconstants.mod physcon.mod atoms_input.mod qmmm_ff_fist.mod cp_log_handling.mod memory_utilities.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'force_fields_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/force_fields_util.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod fist_nonbond_env_types.mod force_field_kind_types.mod shell_potential_types.mod particle_types.mod molecule_types.mod pair_potential_types.mod input_section_types.mod ewald_environment_types.mod force_field_types.mod qmmm_types_low.mod string_utilities.mod kinds.mod cp_output_handling.mod base_hooks.mod force_fields_all.mod cp_units.mod cp_log_handling.mod memory_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/force_fields_util.F force_fields_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:51:07 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_fields_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_fields_util.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'force_fields_util.mod' due to: force_fields_util.o /build/cp2k-Q381vr/cp2k-8.1/src/force_fields_util.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod fist_nonbond_env_types.mod force_field_kind_types.mod shell_potential_types.mod particle_types.mod molecule_types.mod pair_potential_types.mod input_section_types.mod ewald_environment_types.mod force_field_types.mod qmmm_types_low.mod string_utilities.mod kinds.mod cp_output_handling.mod base_hooks.mod force_fields_all.mod cp_units.mod cp_log_handling.mod memory_utilities.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_result_methods.mod' due to: cp_result_methods.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mixed_environment_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mixed_environment_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 mixed_energy_types.mod cp_result_types.mod virial_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_result_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mixed_environment_utils.F mixed_environment_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:51:15 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mixed_environment_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mixed_environment_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mixed_environment_utils.mod' due to: mixed_environment_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/mixed_environment_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 mixed_energy_types.mod cp_result_types.mod virial_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_result_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'colvar_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/colvar_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod mixed_energy_types.mod wannier_states_types.mod molecule_kind_types.mod cell_types.mod force_env_types.mod cp_parser_types.mod particle_types.mod input_enumeration_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod qs_environment_types.mod input_keyword_types.mod particle_list_types.mod mathlib.mod constraint_fxd.mod input_cp2k_colvar.mod string_utilities.mod input_constants.mod spherical_harmonics.mod kinds.mod fparser.mod cp_output_handling.mod force_fields_util.mod base_hooks.mod mixed_environment_utils.mod mathconstants.mod rmsd.mod cp_units.mod cp_log_handling.mod kahan_sum.mod memory_utilities.mod message_passing.mod cp_parser_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/colvar_methods.F colvar_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:51:16 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"colvar_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' colvar_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/colvar_methods.F:1278:70: 1278 | tag_comp = enum_i2c(enum, colvar%xyz_diag_param%component) | 1 Warning: CHARACTER expression will be truncated in assignment (7/80) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/colvar_methods.F:1288:80: 1288 | tag_comp1 = enum_i2c(enum, colvar%xyz_outerdiag_param%components(1)) | 1 Warning: CHARACTER expression will be truncated in assignment (7/80) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/colvar_methods.F:1291:80: 1291 | tag_comp2 = enum_i2c(enum, colvar%xyz_outerdiag_param%components(2)) | 1 Warning: CHARACTER expression will be truncated in assignment (7/80) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/colvar_methods.F:5505:24: 5505 | colvar%ss = cv_val | ^ Warning: ‘cv_val’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/colvar_methods.F:2037:19: 2037 | colvar%ss = r | ^ Warning: ‘r’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/colvar_methods.F:2938:10: 2938 | e, ftmp(3), o0, rcb, rt2, rtmp(3), rtru, ru2, sine, ss(3), xba, xca, xcb, xdb, xdc, xt, & | ^ Warning: ‘e’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/colvar_methods.F:3071:22: 3071 | ftmp(3) = dedzid | ^ Warning: ‘dedzid’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/colvar_methods.F:3067:22: 3067 | ftmp(3) = dedzic | ^ Warning: ‘dedzic’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/colvar_methods.F:3063:22: 3063 | ftmp(3) = dedzib | ^ Warning: ‘dedzib’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/colvar_methods.F:3059:22: 3059 | ftmp(3) = dedzia | ^ Warning: ‘dedzia’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/colvar_methods.F:2937:31: 2937 | dedyib, dedyic, dedyid, dedyt, dedyu, dedzia, dedzib, dedzic, dedzid, dedzt, dedzu, dt, & | ^ Warning: ‘dedyid’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/colvar_methods.F:2937:23: 2937 | dedyib, dedyic, dedyid, dedyt, dedyu, dedzia, dedzib, dedzic, dedzid, dedzt, dedzu, dt, & | ^ Warning: ‘dedyic’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/colvar_methods.F:2937:15: 2937 | dedyib, dedyic, dedyid, dedyt, dedyu, dedzia, dedzib, dedzic, dedzid, dedzt, dedzu, dt, & | ^ Warning: ‘dedyib’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/colvar_methods.F:2936:93: 2936 | REAL(dp) :: angle, cosine, dedphi, dedxia, dedxib, dedxic, dedxid, dedxt, dedxu, dedyia, & | ^ Warning: ‘dedyia’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/colvar_methods.F:2936:71: 2936 | REAL(dp) :: angle, cosine, dedphi, dedxia, dedxib, dedxic, dedxid, dedxt, dedxu, dedyia, & | ^ Warning: ‘dedxid’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/colvar_methods.F:2936:63: 2936 | REAL(dp) :: angle, cosine, dedphi, dedxia, dedxib, dedxic, dedxid, dedxt, dedxu, dedyia, & | ^ Warning: ‘dedxic’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/colvar_methods.F:2936:55: 2936 | REAL(dp) :: angle, cosine, dedphi, dedxia, dedxib, dedxic, dedxid, dedxt, dedxu, dedyia, & | ^ Warning: ‘dedxib’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/colvar_methods.F:2936:47: 2936 | REAL(dp) :: angle, cosine, dedphi, dedxia, dedxib, dedxic, dedxid, dedxt, dedxu, dedyia, & | ^ Warning: ‘dedxia’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'colvar_methods.mod' due to: colvar_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/colvar_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod mixed_energy_types.mod wannier_states_types.mod molecule_kind_types.mod cell_types.mod force_env_types.mod cp_parser_types.mod particle_types.mod input_enumeration_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod qs_environment_types.mod input_keyword_types.mod particle_list_types.mod mathlib.mod constraint_fxd.mod input_cp2k_colvar.mod string_utilities.mod input_constants.mod spherical_harmonics.mod kinds.mod fparser.mod cp_output_handling.mod force_fields_util.mod base_hooks.mod mixed_environment_utils.mod mathconstants.mod rmsd.mod cp_units.mod cp_log_handling.mod kahan_sum.mod memory_utilities.mod message_passing.mod cp_parser_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'colvar_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/colvar_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod molecule_kind_list_types.mod molecule_kind_types.mod cell_types.mod force_env_types.mod particle_types.mod molecule_types.mod molecule_list_types.mod cp_subsys_types.mod distribution_1d_types.mod particle_list_types.mod mathlib.mod string_utilities.mod input_constants.mod kinds.mod base_hooks.mod util.mod rmsd.mod memory_utilities.mod message_passing.mod colvar_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/colvar_utils.F colvar_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:51:42 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"colvar_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' colvar_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'colvar_utils.mod' due to: colvar_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/colvar_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod molecule_kind_list_types.mod molecule_kind_types.mod cell_types.mod force_env_types.mod particle_types.mod molecule_types.mod molecule_list_types.mod cp_subsys_types.mod distribution_1d_types.mod particle_list_types.mod mathlib.mod string_utilities.mod input_constants.mod kinds.mod base_hooks.mod util.mod rmsd.mod memory_utilities.mod message_passing.mod colvar_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'averages_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/averages_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod virial_types.mod md_ener_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_output_handling.mod colvar_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/averages_types.F averages_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:51:47 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/averages_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' averages_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'averages_types.mod' due to: averages_types.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/averages_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod virial_types.mod md_ener_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_output_handling.mod colvar_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'simpar_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/simpar_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/simpar_types.F simpar_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:51:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"simpar_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' simpar_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'simpar_types.mod' due to: simpar_types.o /build/cp2k-Q381vr/cp2k-8.1/src/simpar_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'csvr_system_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/csvr_system_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod extended_system_types.mod input_section_types.mod simpar_types.mod base_hooks.mod kinds.mod bibliography.mod string_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/csvr_system_types.F csvr_system_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:51:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"csvr_system_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' csvr_system_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'csvr_system_types.mod' due to: csvr_system_types.o /build/cp2k-Q381vr/cp2k-8.1/src/csvr_system_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod extended_system_types.mod input_section_types.mod simpar_types.mod base_hooks.mod kinds.mod bibliography.mod string_utilities.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'gle_system_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/gle_system_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod extended_system_types.mod input_section_types.mod base_hooks.mod kinds.mod bibliography.mod string_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/gle_system_types.F gle_system_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:51:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"gle_system_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' gle_system_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'gle_system_types.mod' due to: gle_system_types.o /build/cp2k-Q381vr/cp2k-8.1/src/gle_system_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod extended_system_types.mod input_section_types.mod base_hooks.mod kinds.mod bibliography.mod string_utilities.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'al_system_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/al_system_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 extended_system_types.mod input_section_types.mod simpar_types.mod base_hooks.mod kinds.mod bibliography.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/al_system_types.F al_system_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:51:51 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"al_system_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' al_system_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'al_system_types.mod' due to: al_system_types.o /build/cp2k-Q381vr/cp2k-8.1/src/al_system_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 extended_system_types.mod input_section_types.mod simpar_types.mod base_hooks.mod kinds.mod bibliography.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'thermostat_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 csvr_system_types.mod gle_system_types.mod extended_system_types.mod al_system_types.mod input_section_types.mod simpar_types.mod base_hooks.mod kinds.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_types.F thermostat_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:51:51 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/thermostat_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' thermostat_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'thermostat_types.mod' due to: thermostat_types.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 csvr_system_types.mod gle_system_types.mod extended_system_types.mod al_system_types.mod input_section_types.mod simpar_types.mod base_hooks.mod kinds.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'thermostat_mapping.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_mapping.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod distribution_1d_types.mod extended_system_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod simpar_types.mod base_hooks.mod kinds.mod util.mod memory_utilities.mod message_passing.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_mapping.F thermostat_mapping.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:51:52 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/thermostat_mapping.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' thermostat_mapping.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_mapping.F:576:38: 576 | ALLOCATE (map_info%s_kin(nsize)) | ^ Warning: ‘nsize’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_mapping.F:1071:22: 1071 | const_mol = 0 | ^ Warning: ‘MEM[(struct array01_integer(kind=4) &)&const_mol].dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_mapping.F:554:69: 554 | INTEGER, DIMENSION(:), POINTER :: const_mol, tot_const | ^ note: ‘MEM[(struct array01_integer(kind=4) &)&const_mol].dim[0].ubound’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_mapping.F:983:66: 983 | id_region = map_loc_thermo_gen(iatm) | ^ Warning: ‘iatm’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_mapping.F:830:56: 830 | INTEGER :: atm_offset, first_atom, handle, i, iatm, icount, id_region, ikind, ilist, imol, & | ^ note: ‘iatm’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_mapping.F:121:38: 121 | ALLOCATE (map_info%s_kin(nsize)) | ^ Warning: ‘nsize’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_mapping.F:100:80: 100 | INTEGER, DIMENSION(:), POINTER :: const_mol, tot_const | ^ Warning: ‘MEM[(struct array01_integer(kind=4) &)&tot_const].dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_mapping.F:505:22: 505 | const_mol = 0 | ^ Warning: ‘MEM[(struct array01_integer(kind=4) &)&const_mol].dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_mapping.F:100:69: 100 | INTEGER, DIMENSION(:), POINTER :: const_mol, tot_const | ^ note: ‘MEM[(struct array01_integer(kind=4) &)&const_mol].dim[0].ubound’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'thermostat_mapping.mod' due to: thermostat_mapping.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_mapping.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod distribution_1d_types.mod extended_system_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod simpar_types.mod base_hooks.mod kinds.mod util.mod memory_utilities.mod message_passing.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'extended_system_mapping.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/extended_system_mapping.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod thermostat_types.mod distribution_1d_types.mod extended_system_types.mod molecule_types.mod molecule_kind_types.mod simpar_types.mod base_hooks.mod kinds.mod thermostat_mapping.mod message_passing.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/extended_system_mapping.F extended_system_mapping.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:51:56 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/extended_system_mapping.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' extended_system_mapping.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'extended_system_mapping.mod' due to: extended_system_mapping.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/extended_system_mapping.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod thermostat_types.mod distribution_1d_types.mod extended_system_types.mod molecule_types.mod molecule_kind_types.mod simpar_types.mod base_hooks.mod kinds.mod thermostat_mapping.mod message_passing.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:484: update target '/build/cp2k-Q381vr/cp2k-8.1/obj/git-ref' due to: FORCE echo git:0b61f2f > "/build/cp2k-Q381vr/cp2k-8.1/obj/git-ref.tmp" cmp "/build/cp2k-Q381vr/cp2k-8.1/obj/git-ref.tmp" "/build/cp2k-Q381vr/cp2k-8.1/obj/git-ref" || mv -f "/build/cp2k-Q381vr/cp2k-8.1/obj/git-ref.tmp" "/build/cp2k-Q381vr/cp2k-8.1/obj/git-ref" cmp: /build/cp2k-Q381vr/cp2k-8.1/obj/git-ref: No such file or directory /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp2k_info.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/cp2k_info.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod machine.mod kinds.mod string_utilities.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/obj/git-ref /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/cp2k_info.F cp2k_info.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:51:58 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp2k_info.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp2k_info.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp2k_info.mod' due to: cp2k_info.o /build/cp2k-Q381vr/cp2k-8.1/src/cp2k_info.F machine.mod kinds.mod string_utilities.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'motion_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod force_env_types.mod input_section_types.mod particle_types.mod virial_types.mod particle_list_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod cp2k_info.mod kinds.mod mathlib.mod physcon.mod cp_units.mod machine.mod cp_output_handling.mod input_constants.mod particle_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion_utils.F motion_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:51:58 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' motion_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'motion_utils.mod' due to: motion_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/motion_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod force_env_types.mod input_section_types.mod particle_types.mod virial_types.mod particle_list_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod cp2k_info.mod kinds.mod mathlib.mod physcon.mod cp_units.mod machine.mod cp_output_handling.mod input_constants.mod particle_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'thermostat_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod shell_potential_types.mod particle_types.mod molecule_types.mod input_section_types.mod simpar_types.mod molecule_list_types.mod cp_para_types.mod thermostat_types.mod distribution_1d_types.mod extended_system_types.mod particle_list_types.mod input_constants.mod kinds.mod cp_output_handling.mod base_hooks.mod physcon.mod machine.mod cp_units.mod cp_log_handling.mod motion_utils.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_utils.F thermostat_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:52:01 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/thermostat_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' thermostat_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_utils.F:317:38: 317 | IF ((nmolecule == 1) .AND. (nkind == 1)) nointer = .FALSE. | ^ Warning: ‘nmolecule’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'thermostat_utils.mod' due to: thermostat_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod shell_potential_types.mod particle_types.mod molecule_types.mod input_section_types.mod simpar_types.mod molecule_list_types.mod cp_para_types.mod thermostat_types.mod distribution_1d_types.mod extended_system_types.mod particle_list_types.mod input_constants.mod kinds.mod cp_output_handling.mod base_hooks.mod physcon.mod machine.mod cp_units.mod cp_log_handling.mod motion_utils.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'extended_system_init.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/extended_system_init.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod thermostat_types.mod simpar_types.mod distribution_1d_types.mod extended_system_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod global_types.mod base_hooks.mod extended_system_mapping.mod input_cp2k_binary_restarts.mod kinds.mod thermostat_utils.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/extended_system_init.F extended_system_init.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:52:09 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/extended_system_init.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' extended_system_init.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'extended_system_init.mod' due to: extended_system_init.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/extended_system_init.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod thermostat_types.mod simpar_types.mod distribution_1d_types.mod extended_system_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod global_types.mod base_hooks.mod extended_system_mapping.mod input_cp2k_binary_restarts.mod kinds.mod thermostat_utils.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'barostat_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/barostat_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod input_section_types.mod simpar_types.mod extended_system_types.mod cell_types.mod global_types.mod base_hooks.mod kinds.mod extended_system_init.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/barostat_types.F barostat_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:52:11 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/barostat_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' barostat_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'barostat_types.mod' due to: barostat_types.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/barostat_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod input_section_types.mod simpar_types.mod extended_system_types.mod cell_types.mod global_types.mod base_hooks.mod kinds.mod extended_system_init.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'md_environment_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 free_energy_types.mod force_env_types.mod cp_para_types.mod input_section_types.mod thermal_region_types.mod reftraj_types.mod averages_types.mod thermostat_types.mod barostat_types.mod extended_system_types.mod md_ener_types.mod cell_types.mod simpar_types.mod cp_para_env.mod base_hooks.mod kinds.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_environment_types.F md_environment_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:52:13 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/md_environment_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' md_environment_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'md_environment_types.mod' due to: md_environment_types.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 free_energy_types.mod force_env_types.mod cp_para_types.mod input_section_types.mod thermal_region_types.mod reftraj_types.mod averages_types.mod thermostat_types.mod barostat_types.mod extended_system_types.mod md_ener_types.mod cell_types.mod simpar_types.mod cp_para_env.mod base_hooks.mod kinds.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'reftraj_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/reftraj_util.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 reftraj_types.mod molecule_kind_list_types.mod atomic_kind_types.mod md_environment_types.mod molecule_kind_types.mod force_env_types.mod atomic_kind_list_types.mod particle_types.mod molecule_types.mod input_section_types.mod simpar_types.mod molecule_list_types.mod cp_subsys_types.mod cp_para_types.mod distribution_1d_types.mod particle_list_types.mod kinds.mod cp_output_handling.mod base_hooks.mod util.mod physcon.mod machine.mod cp_files.mod cp_units.mod cp_log_handling.mod message_passing.mod cp_parser_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/reftraj_util.F reftraj_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:52:14 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/reftraj_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' reftraj_util.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mdctrl_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mdctrl_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mdctrl_types.F mdctrl_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:52:17 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mdctrl_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mdctrl_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mdctrl_types.mod' due to: mdctrl_types.o /build/cp2k-Q381vr/cp2k-8.1/src/mdctrl_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_free_energy.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_free_energy.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod input_keyword_types.mod base_hooks.mod kinds.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_free_energy.F input_cp2k_free_energy.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:52:18 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_free_energy.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_free_energy.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_free_energy.mod' due to: input_cp2k_free_energy.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_free_energy.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod input_keyword_types.mod base_hooks.mod kinds.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'metadynamics_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/metadynamics_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cp_para_types.mod force_env_types.mod input_keyword_types.mod metadynamics_types.mod input_enumeration_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod input_constants.mod kinds.mod input_cp2k_free_energy.mod physcon.mod machine.mod cp_output_handling.mod message_passing.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/metadynamics_utils.F metadynamics_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:52:19 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"metadynamics_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' metadynamics_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'metadynamics_utils.mod' due to: metadynamics_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/metadynamics_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cp_para_types.mod force_env_types.mod input_keyword_types.mod metadynamics_types.mod input_enumeration_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod input_constants.mod kinds.mod input_cp2k_free_energy.mod physcon.mod machine.mod cp_output_handling.mod message_passing.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'metadynamics.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/metadynamics.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod cell_types.mod force_env_types.mod input_section_types.mod simpar_types.mod cp_subsys_types.mod metadynamics_types.mod particle_list_types.mod constraint_fxd.mod input_constants.mod kinds.mod bibliography.mod cp_output_handling.mod base_hooks.mod physcon.mod metadynamics_utils.mod reference_manager.mod cp_log_handling.mod message_passing.mod colvar_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/metadynamics.F metadynamics.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:52:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"metadynamics.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' metadynamics.F90 /build/cp2k-Q381vr/cp2k-8.1/src/metadynamics.F:603:22: 603 | IF (scal*check_val > 0.0_dp) CYCLE | ^ Warning: ‘check_val’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'metadynamics.mod' due to: metadynamics.o /build/cp2k-Q381vr/cp2k-8.1/src/metadynamics.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod cell_types.mod force_env_types.mod input_section_types.mod simpar_types.mod cp_subsys_types.mod metadynamics_types.mod particle_list_types.mod constraint_fxd.mod input_constants.mod kinds.mod bibliography.mod cp_output_handling.mod base_hooks.mod physcon.mod metadynamics_utils.mod reference_manager.mod cp_log_handling.mod message_passing.mod colvar_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_thermostats.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_thermostats.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod input_keyword_types.mod input_cp2k_subsys.mod base_hooks.mod kinds.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_thermostats.F input_cp2k_thermostats.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:52:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_thermostats.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_thermostats.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_thermostats.mod' due to: input_cp2k_thermostats.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_thermostats.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod input_keyword_types.mod input_cp2k_subsys.mod base_hooks.mod kinds.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_barostats.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/input_cp2k_barostats.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod barostat_types.mod input_section_types.mod base_hooks.mod kinds.mod input_cp2k_thermostats.mod cp_output_handling.mod string_utilities.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/input_cp2k_barostats.F input_cp2k_barostats.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:52:28 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/input_cp2k_barostats.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_barostats.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_barostats.mod' due to: input_cp2k_barostats.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/input_cp2k_barostats.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod barostat_types.mod input_section_types.mod base_hooks.mod kinds.mod input_cp2k_thermostats.mod cp_output_handling.mod string_utilities.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_md.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/input_cp2k_md.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod input_keyword_types.mod base_hooks.mod kinds.mod bibliography.mod input_cp2k_thermostats.mod input_cp2k_barostats.mod cp_output_handling.mod string_utilities.mod input_constants.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/input_cp2k_md.F input_cp2k_md.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:52:29 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/input_cp2k_md.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_md.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_md.mod' due to: input_cp2k_md.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/input_cp2k_md.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod input_keyword_types.mod base_hooks.mod kinds.mod bibliography.mod input_cp2k_thermostats.mod input_cp2k_barostats.mod cp_output_handling.mod string_utilities.mod input_constants.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'barostat_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/barostat_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 barostat_types.mod extended_system_types.mod cell_types.mod simpar_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod machine.mod cp_output_handling.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/barostat_utils.F barostat_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:52:33 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/barostat_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' barostat_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'barostat_utils.mod' due to: barostat_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/barostat_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 barostat_types.mod extended_system_types.mod cell_types.mod simpar_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod machine.mod cp_output_handling.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'md_conserved_quantities.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_conserved_quantities.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod atomic_kind_types.mod md_environment_types.mod cell_types.mod force_env_types.mod shell_potential_types.mod qmmmx_types.mod atomic_kind_list_types.mod particle_types.mod input_section_types.mod simpar_types.mod cp_subsys_types.mod cp_para_types.mod qmmm_types_low.mod thermostat_types.mod distribution_1d_types.mod extended_system_types.mod md_ener_types.mod particle_list_types.mod input_constants.mod thermostat_utils.mod kinds.mod base_hooks.mod mathconstants.mod physcon.mod message_passing.mod barostat_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_conserved_quantities.F md_conserved_quantities.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:52:35 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/md_conserved_quantities.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' md_conserved_quantities.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'md_conserved_quantities.mod' due to: md_conserved_quantities.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_conserved_quantities.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod atomic_kind_types.mod md_environment_types.mod cell_types.mod force_env_types.mod shell_potential_types.mod qmmmx_types.mod atomic_kind_list_types.mod particle_types.mod input_section_types.mod simpar_types.mod cp_subsys_types.mod cp_para_types.mod qmmm_types_low.mod thermostat_types.mod distribution_1d_types.mod extended_system_types.mod md_ener_types.mod particle_list_types.mod input_constants.mod thermostat_utils.mod kinds.mod base_hooks.mod mathconstants.mod physcon.mod message_passing.mod barostat_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'thermal_region_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermal_region_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod force_env_types.mod thermal_region_types.mod particle_list_types.mod input_section_types.mod simpar_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod memory_utilities.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermal_region_utils.F thermal_region_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:52:39 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermal_region_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' thermal_region_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'thermal_region_utils.mod' due to: thermal_region_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermal_region_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod force_env_types.mod thermal_region_types.mod particle_list_types.mod input_section_types.mod simpar_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod memory_utilities.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'arnoldi_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_types.F arnoldi_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:52:41 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"arnoldi/arnoldi_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' arnoldi_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'arnoldi_types.mod' due to: arnoldi_types.o /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_types.F kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'dbcsr_vector.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/dbcsrx/dbcsr_vector.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/dbcsrx/hash_table.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/src/dbcsrx/hash_table_types.f90 kinds.mod message_passing.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/dbcsrx/dbcsr_vector.F dbcsr_vector.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:52:42 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dbcsrx/dbcsr_vector.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/dbcsrx/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dbcsr_vector.F90 /build/cp2k-Q381vr/cp2k-8.1/src/dbcsrx/dbcsr_vector.F:503:41: 503 | SUBROUTINE dbcsr_matrixT_vector_mult_${nametype}$ (matrix, vec_in, vec_out, alpha, beta, work_row, work_col, skip_diag) | ^ Warning: ‘dbcsr_matrixt_vector_mult_s’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/dbcsrx/dbcsr_vector.F:503:41: 503 | SUBROUTINE dbcsr_matrixT_vector_mult_${nametype}$ (matrix, vec_in, vec_out, alpha, beta, work_row, work_col, skip_diag) | ^ Warning: ‘dbcsr_matrixt_vector_mult_d’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/dbcsrx/dbcsr_vector.F:503:41: 503 | SUBROUTINE dbcsr_matrixT_vector_mult_${nametype}$ (matrix, vec_in, vec_out, alpha, beta, work_row, work_col, skip_diag) | ^ Warning: ‘dbcsr_matrixt_vector_mult_c’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/dbcsrx/dbcsr_vector.F:503:41: 503 | SUBROUTINE dbcsr_matrixT_vector_mult_${nametype}$ (matrix, vec_in, vec_out, alpha, beta, work_row, work_col, skip_diag) | ^ Warning: ‘dbcsr_matrixt_vector_mult_z’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'dbcsr_vector.mod' due to: dbcsr_vector.o /build/cp2k-Q381vr/cp2k-8.1/src/dbcsrx/dbcsr_vector.F /build/cp2k-Q381vr/cp2k-8.1/src/dbcsrx/hash_table.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/src/dbcsrx/hash_table_types.f90 kinds.mod message_passing.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'arnoldi_data_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_data_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_data_selection.f90 /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_data_manipulation.f90 arnoldi_types.mod base_hooks.mod kinds.mod util.mod dbcsr_vector.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_data_methods.F arnoldi_data_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:52:56 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"arnoldi/arnoldi_data_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' arnoldi_data_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_data_methods.F:226:32: 226 | SUBROUTINE set_eval_selection(ar_data, itype) | ^ Warning: ‘set_eval_selection’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_data_methods.F:340:39: 340 | SUBROUTINE get_all_selected_ritz_val(ar_data, eval_out) | ^ Warning: ‘get_all_selected_ritz_val’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_data_methods.F:332:37: 332 | END FUNCTION get_selected_ritz_val | ^ Warning: ‘eval_out’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_data_methods.F:307:64: 307 | FUNCTION get_selected_ritz_val(ar_data, ind) RESULT(eval_out) | ^ note: ‘eval_out’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'arnoldi_data_methods.mod' due to: arnoldi_data_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_data_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_data_selection.f90 /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_data_manipulation.f90 arnoldi_types.mod base_hooks.mod kinds.mod util.mod dbcsr_vector.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'arnoldi_geev.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_geev.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_geev.F arnoldi_geev.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:52:59 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"arnoldi/arnoldi_geev.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' arnoldi_geev.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'arnoldi_geev.mod' due to: arnoldi_geev.o /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_geev.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'arnoldi_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 arnoldi_types.mod base_hooks.mod kinds.mod dbcsr_vector.mod message_passing.mod arnoldi_geev.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_methods.F arnoldi_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:53:03 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"arnoldi/arnoldi_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' arnoldi_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'arnoldi_methods.mod' due to: arnoldi_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 arnoldi_types.mod base_hooks.mod kinds.mod dbcsr_vector.mod message_passing.mod arnoldi_geev.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'arnoldi_api.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_api.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 arnoldi_types.mod base_hooks.mod arnoldi_data_methods.mod kinds.mod dbcsr_vector.mod arnoldi_methods.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_api.F arnoldi_api.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:53:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"arnoldi/arnoldi_api.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' arnoldi_api.F90 /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_api.F:493:13: 493 | IF (SQRT(rsnew) < control%threshold) control%converged = .TRUE. | ^ Warning: ‘rsnew’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_api.F:399:83: 399 | REAL(KIND=dp) :: alpha, beta, pap, rsnew, rsold | ^ note: ‘rsnew’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'arnoldi_api.mod' due to: arnoldi_api.o /build/cp2k-Q381vr/cp2k-8.1/src/arnoldi/arnoldi_api.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 arnoldi_types.mod base_hooks.mod arnoldi_data_methods.mod kinds.mod dbcsr_vector.mod arnoldi_methods.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'submatrix_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/submatrix_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod kinds.mod util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/submatrix_types.F submatrix_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:53:25 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"submatrix_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' submatrix_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'submatrix_types.mod' due to: submatrix_types.o /build/cp2k-Q381vr/cp2k-8.1/src/submatrix_types.F kinds.mod util.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'submatrix_dissection.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/submatrix_dissection.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 submatrix_types.mod base_hooks.mod kinds.mod bibliography.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/submatrix_dissection.F submatrix_dissection.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:53:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"submatrix_dissection.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' submatrix_dissection.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'submatrix_dissection.mod' due to: submatrix_dissection.o /build/cp2k-Q381vr/cp2k-8.1/src/submatrix_dissection.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 submatrix_types.mod base_hooks.mod kinds.mod bibliography.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'iterate_matrix.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/iterate_matrix.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod arnoldi_api.mod mathconstants.mod bibliography.mod machine.mod message_passing.mod input_constants.mod submatrix_dissection.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/iterate_matrix.F iterate_matrix.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:53:33 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"iterate_matrix.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' iterate_matrix.F90 /build/cp2k-Q381vr/cp2k-8.1/src/iterate_matrix.F:2128:32: 2128 | SUBROUTINE matrix_exponential(matrix_exp, matrix, omega, alpha, threshold) | ^ Warning: ‘matrix_exponential’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'iterate_matrix.mod' due to: iterate_matrix.o /build/cp2k-Q381vr/cp2k-8.1/src/iterate_matrix.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod arnoldi_api.mod mathconstants.mod bibliography.mod machine.mod message_passing.mod input_constants.mod submatrix_dissection.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'preconditioner_solvers.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/preconditioner_solvers.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod preconditioner_types.mod cp_fm_types.mod base_hooks.mod kinds.mod arnoldi_api.mod cp_fm_struct.mod cp_blacs_env.mod bibliography.mod cp_fm_basic_linalg.mod iterate_matrix.mod input_constants.mod cp_dbcsr_operations.mod cp_fm_cholesky.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/preconditioner_solvers.F preconditioner_solvers.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:53:39 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"preconditioner_solvers.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' preconditioner_solvers.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'preconditioner_solvers.mod' due to: preconditioner_solvers.o /build/cp2k-Q381vr/cp2k-8.1/src/preconditioner_solvers.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod preconditioner_types.mod cp_fm_types.mod base_hooks.mod kinds.mod arnoldi_api.mod cp_fm_struct.mod cp_blacs_env.mod bibliography.mod cp_fm_basic_linalg.mod iterate_matrix.mod input_constants.mod cp_dbcsr_operations.mod cp_fm_cholesky.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_gemm_interface.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/cp_gemm_interface.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod kinds.mod cp_fm_basic_linalg.mod string_utilities.mod message_passing.mod input_constants.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/cp_gemm_interface.F cp_gemm_interface.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:53:40 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_gemm_interface.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_gemm_interface.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_gemm_interface.mod' due to: cp_gemm_interface.o /build/cp2k-Q381vr/cp2k-8.1/src/cp_gemm_interface.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod kinds.mod cp_fm_basic_linalg.mod string_utilities.mod message_passing.mod input_constants.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'preconditioner_apply.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/preconditioner_apply.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 preconditioner_types.mod cp_fm_types.mod base_hooks.mod kinds.mod input_constants.mod cp_fm_cholesky.mod cp_gemm_interface.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/preconditioner_apply.F preconditioner_apply.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:53:40 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"preconditioner_apply.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' preconditioner_apply.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'preconditioner_apply.mod' due to: preconditioner_apply.o /build/cp2k-Q381vr/cp2k-8.1/src/preconditioner_apply.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 preconditioner_types.mod cp_fm_types.mod base_hooks.mod kinds.mod input_constants.mod cp_fm_cholesky.mod cp_gemm_interface.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_fm_diag.mod' due to: cp_fm_diag.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'preconditioner_makes.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/preconditioner_makes.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 preconditioner_types.mod cp_fm_types.mod base_hooks.mod kinds.mod arnoldi_api.mod cp_fm_struct.mod cp_fm_diag.mod cp_fm_basic_linalg.mod input_constants.mod cp_dbcsr_operations.mod cp_fm_cholesky.mod cp_gemm_interface.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/preconditioner_makes.F preconditioner_makes.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:53:41 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"preconditioner_makes.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' preconditioner_makes.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'preconditioner_makes.mod' due to: preconditioner_makes.o /build/cp2k-Q381vr/cp2k-8.1/src/preconditioner_makes.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 preconditioner_types.mod cp_fm_types.mod base_hooks.mod kinds.mod arnoldi_api.mod cp_fm_struct.mod cp_fm_diag.mod cp_fm_basic_linalg.mod input_constants.mod cp_dbcsr_operations.mod cp_fm_cholesky.mod cp_gemm_interface.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'admm_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/admm_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 admm_types.mod base_hooks.mod kinds.mod input_constants.mod cp_dbcsr_operations.mod cp_gemm_interface.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/admm_utils.F admm_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:53:43 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"admm_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' admm_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'admm_utils.mod' due to: admm_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/admm_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 admm_types.mod base_hooks.mod kinds.mod input_constants.mod cp_dbcsr_operations.mod cp_gemm_interface.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fermi_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fermi_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod kahan_sum.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fermi_utils.F fermi_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:53:44 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fermi_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fermi_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fermi_utils.mod' due to: fermi_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/fermi_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod kahan_sum.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_mo_occupation.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_occupation.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xas_env_types.mod qs_mo_types.mod scf_control_types.mod base_hooks.mod cp_log_handling.mod kinds.mod kahan_sum.mod util.mod input_constants.mod fermi_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_occupation.F qs_mo_occupation.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:53:45 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_mo_occupation.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_mo_occupation.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_occupation.F:157:26: 157 | homo_a = lfomo_a - 1 | ^ Warning: ‘lfomo_a’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_occupation.F:164:26: 164 | homo_b = lfomo_b - 1 | ^ Warning: ‘lfomo_b’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_mo_occupation.mod' due to: qs_mo_occupation.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_occupation.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xas_env_types.mod qs_mo_types.mod scf_control_types.mod base_hooks.mod cp_log_handling.mod kinds.mod kahan_sum.mod util.mod input_constants.mod fermi_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_cfm_diag.mod' due to: cp_cfm_diag.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_dbcsr_diag.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/cp_dbcsr_diag.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_cfm_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_cfm_diag.mod cp_fm_struct.mod cp_blacs_env.mod cp_fm_diag.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/cp_dbcsr_diag.F cp_dbcsr_diag.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:53:48 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_dbcsr_diag.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_dbcsr_diag.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_dbcsr_diag.mod' due to: cp_dbcsr_diag.o /build/cp2k-Q381vr/cp2k-8.1/src/cp_dbcsr_diag.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_cfm_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_cfm_diag.mod cp_fm_struct.mod cp_blacs_env.mod cp_fm_diag.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_mo_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 admm_types.mod cp_fm_types.mod qs_mo_types.mod scf_control_types.mod cp_para_types.mod cp_fm_struct.mod admm_utils.mod cp_fm_diag.mod qs_mo_occupation.mod kinds.mod cp_blacs_env.mod cp_dbcsr_diag.mod base_hooks.mod physcon.mod cp_fm_basic_linalg.mod cp_fm_cholesky.mod cp_gemm_interface.mod cp_log_handling.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_methods.F qs_mo_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:53:49 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_mo_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_mo_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_mo_methods.mod' due to: qs_mo_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 admm_types.mod cp_fm_types.mod qs_mo_types.mod scf_control_types.mod cp_para_types.mod cp_fm_struct.mod admm_utils.mod cp_fm_diag.mod qs_mo_occupation.mod kinds.mod cp_blacs_env.mod cp_dbcsr_diag.mod base_hooks.mod physcon.mod cp_fm_basic_linalg.mod cp_fm_cholesky.mod cp_gemm_interface.mod cp_log_handling.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'preconditioner.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/preconditioner.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod cp_control_types.mod preconditioner_types.mod qs_mo_types.mod cp_fm_types.mod base_hooks.mod kinds.mod preconditioner_solvers.mod cp_blacs_env.mod preconditioner_apply.mod preconditioner_makes.mod qs_mo_methods.mod input_constants.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/preconditioner.F preconditioner.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:53:51 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"preconditioner.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' preconditioner.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'preconditioner.mod' due to: preconditioner.o /build/cp2k-Q381vr/cp2k-8.1/src/preconditioner.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod cp_control_types.mod preconditioner_types.mod qs_mo_types.mod cp_fm_types.mod base_hooks.mod kinds.mod preconditioner_solvers.mod cp_blacs_env.mod preconditioner_apply.mod preconditioner_makes.mod qs_mo_methods.mod input_constants.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_external_control.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/cp_external_control.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 global_types.mod base_hooks.mod kinds.mod cp_log_handling.mod machine.mod message_passing.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/cp_external_control.F cp_external_control.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:53:55 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_external_control.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_external_control.F90 /build/cp2k-Q381vr/cp2k-8.1/src/cp_external_control.F:208:53: 208 | time_check = m_walltime() - my_start_time | ^ Warning: ‘my_start_time’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_external_control.mod' due to: cp_external_control.o /build/cp2k-Q381vr/cp2k-8.1/src/cp_external_control.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 global_types.mod base_hooks.mod kinds.mod cp_log_handling.mod machine.mod message_passing.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'matrix_exp.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/matrix_exp.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_cfm_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_cfm_basic_linalg.mod cp_fm_struct.mod mathconstants.mod cp_fm_basic_linalg.mod message_passing.mod cp_gemm_interface.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/matrix_exp.F matrix_exp.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:53:55 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"matrix_exp.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' matrix_exp.F90 /build/cp2k-Q381vr/cp2k-8.1/src/matrix_exp.F:518:89: 518 | Npq%local_data(:, k) = Npq%local_data(:, k) + scaleN*Tres%local_data(:, k) | ^ Warning: ‘REALPART_EXPR ’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'matrix_exp.mod' due to: matrix_exp.o /build/cp2k-Q381vr/cp2k-8.1/src/matrix_exp.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_cfm_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_cfm_basic_linalg.mod cp_fm_struct.mod mathconstants.mod cp_fm_basic_linalg.mod message_passing.mod cp_gemm_interface.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_localization_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_localization_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cell_types.mod cp_fm_types.mod cp_cfm_types.mod cp_para_types.mod cp_fm_struct.mod cp_fm_diag.mod cp_external_control.mod kinds.mod matrix_exp.mod cp_blacs_env.mod cp_cfm_basic_linalg.mod base_hooks.mod cp_cfm_diag.mod mathconstants.mod machine.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_log_handling.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_localization_methods.F qs_localization_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:54:01 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_localization_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_localization_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_localization_methods.F:1802:71: 1802 | ii = nblock_max*ip_has_i + i - ns_bound(ip_has_i, 1) + 1 | ^ Warning: ‘ip_has_i’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_localization_methods.F:1374:64: 1374 | REAL(dp), ALLOCATABLE, DIMENSION(:, :) :: gmat, rmat_loc, rmat_recv, rmat_send, & | ^ Warning: ‘gmat.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_localization_methods.F:1374:64: Warning: ‘gmat.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_localization_methods.mod' due to: qs_localization_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_localization_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cell_types.mod cp_fm_types.mod cp_cfm_types.mod cp_para_types.mod cp_fm_struct.mod cp_fm_diag.mod cp_external_control.mod kinds.mod matrix_exp.mod cp_blacs_env.mod cp_cfm_basic_linalg.mod base_hooks.mod cp_cfm_diag.mod mathconstants.mod machine.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_log_handling.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_loc_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod block_p_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_loc_types.mod qs_environment_types.mod qs_neighbor_list_types.mod distribution_1d_types.mod cp_fm_struct.mod cp_array_utils.mod cp_fm_diag.mod qs_mo_methods.mod input_constants.mod kinds.mod ai_moments.mod cp_output_handling.mod base_hooks.mod mathconstants.mod qs_localization_methods.mod cp_fm_basic_linalg.mod cp_files.mod cp_gemm_interface.mod cp_log_handling.mod memory_utilities.mod orbital_pointers.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_utils.F qs_loc_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:54:14 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_loc_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_loc_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_utils.F:819:13: 819 | IF (jatom /= last_jatom) THEN | ^ Warning: ‘last_jatom’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_utils.F:539:25: 539 | IF (ABS(occ_imo - my_occ) > localized_wfn_control%eps_occ) THEN | ^ Warning: ‘my_occ’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_loc_utils.mod' due to: qs_loc_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod block_p_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_loc_types.mod qs_environment_types.mod qs_neighbor_list_types.mod distribution_1d_types.mod cp_fm_struct.mod cp_array_utils.mod cp_fm_diag.mod qs_mo_methods.mod input_constants.mod kinds.mod ai_moments.mod cp_output_handling.mod base_hooks.mod mathconstants.mod qs_localization_methods.mod cp_fm_basic_linalg.mod cp_files.mod cp_gemm_interface.mod cp_log_handling.mod memory_utilities.mod orbital_pointers.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'atomic_charges.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/atomic_charges.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod qs_kind_types.mod atomic_kind_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/atomic_charges.F atomic_charges.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:54:21 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atomic_charges.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atomic_charges.F90 /build/cp2k-Q381vr/cp2k-8.1/src/atomic_charges.F:136:30: 136 | SUBROUTINE print_multipoles(particle_set, qs_kind_set, scr, charge, dipole, quadrupole) | ^ Warning: ‘print_multipoles’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'atomic_charges.mod' due to: atomic_charges.o /build/cp2k-Q381vr/cp2k-8.1/src/atomic_charges.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod qs_kind_types.mod atomic_kind_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mulliken.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mulliken.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_control_types.mod particle_types.mod qs_kind_types.mod base_hooks.mod kinds.mod atomic_charges.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mulliken.F mulliken.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:54:22 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mulliken.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mulliken.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mulliken.mod' due to: mulliken.o /build/cp2k-Q381vr/cp2k-8.1/src/mulliken.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_control_types.mod particle_types.mod qs_kind_types.mod base_hooks.mod kinds.mod atomic_charges.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'hfx_contraction_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/hfxbase/hfx_contraction_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/hfxbase/hfx_contraction_methods.F hfx_contraction_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:54:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfxbase/hfx_contraction_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/hfxbase/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_contraction_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'hfx_contraction_methods.mod' due to: hfx_contraction_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/hfxbase/hfx_contraction_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'hfx_libint_interface.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/hfx_libint_interface.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod cell_types.mod base_hooks.mod kinds.mod gamma.mod hfx_contraction_methods.mod mathconstants.mod libint_wrapper.mod orbital_pointers.mod input_constants.mod t_c_g0.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/hfx_libint_interface.F hfx_libint_interface.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:55:38 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_libint_interface.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_libint_interface.F90 /build/cp2k-Q381vr/cp2k-8.1/src/hfx_libint_interface.F:259:37: 259 | factor = factor*S1234*SQRT(tmp) | ^ Warning: ‘factor’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'hfx_libint_interface.mod' due to: hfx_libint_interface.o /build/cp2k-Q381vr/cp2k-8.1/src/hfx_libint_interface.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod cell_types.mod base_hooks.mod kinds.mod gamma.mod hfx_contraction_methods.mod mathconstants.mod libint_wrapper.mod orbital_pointers.mod input_constants.mod t_c_g0.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'hfx_screening_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/hfx_screening_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod hfx_types.mod qs_environment_types.mod qs_kind_types.mod base_hooks.mod kinds.mod machine.mod ao_util.mod libint_wrapper.mod orbital_pointers.mod powell.mod hfx_libint_interface.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/hfx_screening_methods.F hfx_screening_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:55:52 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_screening_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_screening_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'hfx_screening_methods.mod' due to: hfx_screening_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/hfx_screening_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod hfx_types.mod qs_environment_types.mod qs_kind_types.mod base_hooks.mod kinds.mod machine.mod ao_util.mod libint_wrapper.mod orbital_pointers.mod powell.mod hfx_libint_interface.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'hfx_contract_block.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/hfxbase/hfx_contract_block.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/hfxbase/hfx_contract_block.F hfx_contract_block.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:55:58 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfxbase/hfx_contract_block.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/hfxbase/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_contract_block.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'hfx_contract_block.mod' due to: hfx_contract_block.o /build/cp2k-Q381vr/cp2k-8.1/src/hfxbase/hfx_contract_block.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 't_sh_p_s_c.mod' due to: t_sh_p_s_c.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'hfx_pair_list_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/hfx_pair_list_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod mp2_types.mod particle_types.mod cell_types.mod base_hooks.mod kinds.mod gamma.mod mathconstants.mod libint_wrapper.mod input_constants.mod t_sh_p_s_c.mod t_c_g0.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/hfx_pair_list_methods.F hfx_pair_list_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:56:51 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_pair_list_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_pair_list_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/hfx_pair_list_methods.F:295:46: 295 | factor = factor*S1234*SQRT(tmp) | ^ Warning: ‘factor’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'hfx_pair_list_methods.mod' due to: hfx_pair_list_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/hfx_pair_list_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod mp2_types.mod particle_types.mod cell_types.mod base_hooks.mod kinds.mod gamma.mod mathconstants.mod libint_wrapper.mod input_constants.mod t_sh_p_s_c.mod t_c_g0.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'hfx_load_balance_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/hfx_load_balance_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod parallel_rng_types.mod particle_types.mod cell_types.mod base_hooks.mod kinds.mod input_constants.mod util.mod hfx_pair_list_methods.mod message_passing.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/hfx_load_balance_methods.F hfx_load_balance_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:56:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_load_balance_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_load_balance_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/hfx_load_balance_methods.F:2360:45: 2360 | shm_bins_per_rank(i_thread + 1) = nbins | ^ Warning: ‘nbins’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_load_balance_methods.F:1997:94: 1997 | REAL(dp), DIMENSION(:, :), POINTER :: ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4 | ^ Warning: ‘ptr_p_4.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_load_balance_methods.F:1997:94: Warning: ‘ptr_p_4.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_load_balance_methods.F:1997:94: Warning: ‘ptr_p_4.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90:224:36: 224 | pmax_4 = ptr_p_4(jset, kset) | ^ Warning: ‘ptr_p_4.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_load_balance_methods.F:1997:94: 1997 | REAL(dp), DIMENSION(:, :), POINTER :: ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4 | ^ note: ‘ptr_p_4.data’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_load_balance_methods.F:1997:85: 1997 | REAL(dp), DIMENSION(:, :), POINTER :: ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4 | ^ Warning: ‘ptr_p_3.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_load_balance_methods.F:1997:85: Warning: ‘ptr_p_3.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_load_balance_methods.F:1997:85: Warning: ‘ptr_p_3.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90:223:36: 223 | pmax_3 = ptr_p_3(iset, lset) | ^ Warning: ‘ptr_p_3.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_load_balance_methods.F:1997:85: 1997 | REAL(dp), DIMENSION(:, :), POINTER :: ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4 | ^ note: ‘ptr_p_3.data’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_load_balance_methods.F:1997:76: 1997 | REAL(dp), DIMENSION(:, :), POINTER :: ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4 | ^ Warning: ‘ptr_p_2.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_load_balance_methods.F:1997:76: Warning: ‘ptr_p_2.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_load_balance_methods.F:1997:76: Warning: ‘ptr_p_2.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90:222:36: 222 | pmax_2 = ptr_p_2(jset, lset) | ^ Warning: ‘ptr_p_2.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_load_balance_methods.F:1997:76: 1997 | REAL(dp), DIMENSION(:, :), POINTER :: ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4 | ^ note: ‘ptr_p_2.data’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_load_balance_methods.F:1997:67: 1997 | REAL(dp), DIMENSION(:, :), POINTER :: ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4 | ^ Warning: ‘ptr_p_1.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_load_balance_methods.F:1997:67: Warning: ‘ptr_p_1.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_load_balance_methods.F:1997:67: Warning: ‘ptr_p_1.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90:221:36: 221 | pmax_1 = ptr_p_1(iset, kset) | ^ Warning: ‘ptr_p_1.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_load_balance_methods.F:1997:67: 1997 | REAL(dp), DIMENSION(:, :), POINTER :: ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4 | ^ note: ‘ptr_p_1.data’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_load_balance_methods.F:1991:77: 1991 | jset, katom, kind_kind_idx, kkind, kset, latom, lkind, lset, swap_id | ^ Warning: ‘swap_id’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_load_balance_methods.F:1546:58: 1546 | bin_histogram(my_process_id + 1, 1) = my_bin_size | ^ Warning: ‘my_bin_size’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'hfx_load_balance_methods.mod' due to: hfx_load_balance_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/hfx_load_balance_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod parallel_rng_types.mod particle_types.mod cell_types.mod base_hooks.mod kinds.mod input_constants.mod util.mod hfx_pair_list_methods.mod message_passing.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'hfx_communication.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/hfx_communication.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod atomic_kind_types.mod base_hooks.mod kinds.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/hfx_communication.F hfx_communication.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:57:03 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_communication.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_communication.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'hfx_communication.mod' due to: hfx_communication.o /build/cp2k-Q381vr/cp2k-8.1/src/hfx_communication.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod atomic_kind_types.mod base_hooks.mod kinds.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'hfx_energy_potential.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod cp_control_types.mod kpoint_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod gamma.mod hfx_compression_methods.mod hfx_screening_methods.mod input_constants.mod hfx_contract_block.mod kinds.mod bibliography.mod cp_output_handling.mod hfx_libint_interface.mod base_hooks.mod util.mod mathconstants.mod machine.mod hfx_load_balance_methods.mod libint_wrapper.mod cp_files.mod cp_log_handling.mod hfx_pair_list_methods.mod orbital_pointers.mod message_passing.mod hfx_communication.mod t_c_g0.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F hfx_energy_potential.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:57:07 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_energy_potential.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_energy_potential.F90 /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:205:74: 205 | full_ks_beta, max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, & | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_4].dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:205:74: Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_4].dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90:128:36: 128 | pmax_4 = ptr_p_4(jset, kset) | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_4].span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:205:74: 205 | full_ks_beta, max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, & | ^ note: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_4].span’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:205:74: Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_4].offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90:128:36: 128 | pmax_4 = ptr_p_4(jset, kset) | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_4].data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:205:74: 205 | full_ks_beta, max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, & | ^ note: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_4].data’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:205:65: 205 | full_ks_beta, max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, & | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_3].dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:205:65: Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_3].dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90:127:36: 127 | pmax_3 = ptr_p_3(iset, lset) | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_3].span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:205:65: 205 | full_ks_beta, max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, & | ^ note: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_3].span’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:205:65: Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_3].offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90:127:36: 127 | pmax_3 = ptr_p_3(iset, lset) | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_3].data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:205:65: 205 | full_ks_beta, max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, & | ^ note: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_3].data’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:205:56: 205 | full_ks_beta, max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, & | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_2].dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:205:56: Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_2].dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90:126:36: 126 | pmax_2 = ptr_p_2(jset, lset) | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_2].span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:205:56: 205 | full_ks_beta, max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, & | ^ note: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_2].span’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:205:56: Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_2].offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90:126:36: 126 | pmax_2 = ptr_p_2(jset, lset) | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_2].data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:205:56: 205 | full_ks_beta, max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, & | ^ note: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_2].data’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:205:47: 205 | full_ks_beta, max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, & | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_1].dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:205:47: Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_1].dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90:125:36: 125 | pmax_1 = ptr_p_1(iset, kset) | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_1].span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:205:47: 205 | full_ks_beta, max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, & | ^ note: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_1].span’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:205:47: Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_1].offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90:125:36: 125 | pmax_1 = ptr_p_1(iset, kset) | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_1].data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:205:47: 205 | full_ks_beta, max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, & | ^ note: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_1].data’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:168:60: 168 | sphi_c_u3, sphi_d_u1, sphi_d_u2, sphi_d_u3, swap_id, tmp_i4, unit_id | ^ Warning: ‘swap_id’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:222:79: 222 | TYPE(hfx_container_type), DIMENSION(:), POINTER :: integral_containers, & | ^ Warning: ‘integral_containers.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:222:79: Warning: ‘integral_containers.span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:222:79: Warning: ‘integral_containers.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:1645:86: 1645 | use_disk_storage) | ^ Warning: ‘integral_containers.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:222:79: 222 | TYPE(hfx_container_type), DIMENSION(:), POINTER :: integral_containers, & | ^ note: ‘integral_containers.data’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:220:75: 220 | TYPE(hfx_cache_type), DIMENSION(:), POINTER :: integral_caches, integral_caches_disk | ^ Warning: ‘integral_caches.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:220:75: Warning: ‘integral_caches.span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:220:75: Warning: ‘integral_caches.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:1645:86: 1645 | use_disk_storage) | ^ Warning: ‘integral_caches.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:220:75: 220 | TYPE(hfx_cache_type), DIMENSION(:), POINTER :: integral_caches, integral_caches_disk | ^ note: ‘integral_caches.data’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:1588:69: 1588 | use_disk_storage, max_val_memory) | ^ Warning: ‘maxval_container’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:224:76: 224 | TYPE(hfx_container_type), POINTER :: maxval_container, maxval_container_disk | ^ note: ‘maxval_container’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:1588:69: 1588 | use_disk_storage, max_val_memory) | ^ Warning: ‘maxval_cache’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:221:72: 221 | TYPE(hfx_cache_type), POINTER :: maxval_cache, maxval_cache_disk | ^ note: ‘maxval_cache’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:220:97: 220 | TYPE(hfx_cache_type), DIMENSION(:), POINTER :: integral_caches, integral_caches_disk | ^ Warning: ‘integral_caches_disk.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:223:84: 223 | integral_containers_disk | ^ Warning: ‘integral_containers_disk.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:2117:91: 2117 | memory_parameter%actual_memory_usage_disk, .TRUE.) | ^ Warning: ‘integral_containers_disk.span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:223:84: 223 | integral_containers_disk | ^ note: ‘integral_containers_disk.span’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:2117:91: 2117 | memory_parameter%actual_memory_usage_disk, .TRUE.) | ^ Warning: ‘integral_containers_disk.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:223:84: 223 | integral_containers_disk | ^ note: ‘integral_containers_disk.offset’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:2117:91: 2117 | memory_parameter%actual_memory_usage_disk, .TRUE.) | ^ Warning: ‘integral_containers_disk.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:223:84: 223 | integral_containers_disk | ^ note: ‘integral_containers_disk.data’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:2122:60: 2122 | do_disk_storage) | ^ Warning: ‘maxval_container_disk’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:224:99: 224 | TYPE(hfx_container_type), POINTER :: maxval_container, maxval_container_disk | ^ note: ‘maxval_container_disk’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:2122:60: 2122 | do_disk_storage) | ^ Warning: ‘maxval_cache_disk’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F:221:91: 221 | TYPE(hfx_cache_type), POINTER :: maxval_cache, maxval_cache_disk | ^ note: ‘maxval_cache_disk’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'hfx_energy_potential.mod' due to: hfx_energy_potential.o /build/cp2k-Q381vr/cp2k-8.1/src/hfx_energy_potential.F /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod cp_control_types.mod kpoint_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod gamma.mod hfx_compression_methods.mod hfx_screening_methods.mod input_constants.mod hfx_contract_block.mod kinds.mod bibliography.mod cp_output_handling.mod hfx_libint_interface.mod base_hooks.mod util.mod mathconstants.mod machine.mod hfx_load_balance_methods.mod libint_wrapper.mod cp_files.mod cp_log_handling.mod hfx_pair_list_methods.mod orbital_pointers.mod message_passing.mod hfx_communication.mod t_c_g0.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rs_pw_interface.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw_env/rs_pw_interface.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod pw_env_types.mod realspace_grid_types.mod input_section_types.mod pw_types.mod base_hooks.mod cp_log_handling.mod kinds.mod gaussian_gridlevels.mod cp_spline_utils.mod pw_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw_env/rs_pw_interface.F rs_pw_interface.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:57:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw_env/rs_pw_interface.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/pw_env/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rs_pw_interface.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rs_pw_interface.mod' due to: rs_pw_interface.o /build/cp2k-Q381vr/cp2k-8.1/src/pw_env/rs_pw_interface.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod pw_env_types.mod realspace_grid_types.mod input_section_types.mod pw_types.mod base_hooks.mod cp_log_handling.mod kinds.mod gaussian_gridlevels.mod cp_spline_utils.mod pw_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'task_list_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/task_list_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/common/array_sort.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod cell_types.mod basis_set_types.mod cp_control_types.mod realspace_grid_types.mod kpoint_types.mod task_list_types.mod particle_types.mod qs_neighbor_list_types.mod pw_env_types.mod particle_methods.mod kinds.mod base_hooks.mod util.mod ao_util.mod gaussian_gridlevels.mod memory_utilities.mod cube_utils.mod message_passing.mod grid_api.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/task_list_methods.F task_list_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:57:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"task_list_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' task_list_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/task_list_methods.F:1015:66: 1015 | ilocal, k, maxdest, Ncpu, Nflux | ^ Warning: ‘ilocal’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/task_list_methods.F:402:46: 402 | task_list%npairs(igrid_level) = ipair | ^ Warning: ‘igrid_level’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'task_list_methods.mod' due to: task_list_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/task_list_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/common/array_sort.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod cell_types.mod basis_set_types.mod cp_control_types.mod realspace_grid_types.mod kpoint_types.mod task_list_types.mod particle_types.mod qs_neighbor_list_types.mod pw_env_types.mod particle_methods.mod kinds.mod base_hooks.mod util.mod ao_util.mod gaussian_gridlevels.mod memory_utilities.mod cube_utils.mod message_passing.mod grid_api.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_integrate_potential_product.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_integrate_potential_product.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod realspace_grid_types.mod task_list_types.mod particle_types.mod qs_environment_types.mod pw_env_types.mod input_constants.mod kinds.mod base_hooks.mod rs_pw_interface.mod gaussian_gridlevels.mod cube_utils.mod grid_api.mod task_list_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_integrate_potential_product.F qs_integrate_potential_product.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:57:37 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_integrate_potential_product.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_integrate_potential_product.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_integrate_potential_product.mod' due to: qs_integrate_potential_product.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_integrate_potential_product.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod realspace_grid_types.mod task_list_types.mod particle_types.mod qs_environment_types.mod pw_env_types.mod input_constants.mod kinds.mod base_hooks.mod rs_pw_interface.mod gaussian_gridlevels.mod cube_utils.mod grid_api.mod task_list_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_integrate_potential_single.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_integrate_potential_single.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod lri_environment_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod basis_set_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod realspace_grid_types.mod atprop_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod pw_env_types.mod external_potential_types.mod kinds.mod base_hooks.mod rs_pw_interface.mod ao_util.mod gaussian_gridlevels.mod memory_utilities.mod orbital_pointers.mod message_passing.mod grid_api.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_integrate_potential_single.F qs_integrate_potential_single.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:57:40 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_integrate_potential_single.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_integrate_potential_single.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_integrate_potential_single.mod' due to: qs_integrate_potential_single.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_integrate_potential_single.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod lri_environment_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod basis_set_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod realspace_grid_types.mod atprop_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod pw_env_types.mod external_potential_types.mod kinds.mod base_hooks.mod rs_pw_interface.mod ao_util.mod gaussian_gridlevels.mod memory_utilities.mod orbital_pointers.mod message_passing.mod grid_api.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_integrate_potential.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_integrate_potential.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod grid_api.mod qs_integrate_potential_product.mod qs_integrate_potential_single.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_integrate_potential.F qs_integrate_potential.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:57:46 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_integrate_potential.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_integrate_potential.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_integrate_potential.mod' due to: qs_integrate_potential.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_integrate_potential.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod grid_api.mod qs_integrate_potential_product.mod qs_integrate_potential_single.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_functionals_utilities.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_functionals_utilities.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_functionals_utilities.F xc_functionals_utilities.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:57:47 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_functionals_utilities.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_functionals_utilities.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_functionals_utilities.F:68:31: 68 | SUBROUTINE setup_calculation(order, m, calc, tag) | ^ Warning: ‘setup_calculation’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_functionals_utilities.mod' due to: xc_functionals_utilities.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_functionals_utilities.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_perdew_zunger.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_zunger.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod input_section_types.mod xc_rho_set_types.mod base_hooks.mod xc_functionals_utilities.mod kinds.mod bibliography.mod xc_input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_zunger.F xc_perdew_zunger.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:57:48 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_perdew_zunger.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_perdew_zunger.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_zunger.F:714:74: 714 | + trz*r(1)*z(0, 2) + tzz*z(0, 2)*z(1, 0) + tz*z(1, 2) | ^ Warning: ‘tzz’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_zunger.F:617:63: 617 | tzz, tzzz | ^ note: ‘tzz’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_zunger.F:682:56: 682 | + tr*r(2) + tzz*z(1, 0)**2 + tz*z(2, 0) | ^ Warning: ‘trz’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_zunger.F:616:89: 616 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & | ^ note: ‘trz’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_zunger.F:682:56: 682 | + tr*r(2) + tzz*z(1, 0)**2 + tz*z(2, 0) | ^ Warning: ‘trr’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_zunger.F:616:72: 616 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & | ^ note: ‘trr’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_zunger.F:675:41: 675 | ed(m + 1) = tr*r(1) + tz*z(0, 1) | ^ Warning: ‘tz’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_zunger.F:616:99: 616 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & | ^ note: ‘tz’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_zunger.F:673:37: 673 | ed(m) = tr*r(1) + tz*z(1, 0) | ^ Warning: ‘tr’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_zunger.F:616:67: 616 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & | ^ note: ‘tr’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_zunger.F:720:62: 720 | + 3.0_dp*tzz*z(0, 1)*z(0, 2) + tz*z(0, 3) | ^ Warning: ‘tzzz’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_zunger.F:617:69: 617 | tzz, tzzz | ^ note: ‘tzzz’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_zunger.F:706:74: 706 | + trz*r(1)*z(2, 0) + tzz*z(2, 0)*z(0, 1) + tz*z(2, 1) | ^ Warning: ‘trzz’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_zunger.F:616:95: 616 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & | ^ note: ‘trzz’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_zunger.F:698:58: 698 | + 3.0_dp*tzz*z(1, 0)*z(2, 0) + tz*z(3, 0) | ^ Warning: ‘trrz’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_zunger.F:616:84: 616 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & | ^ note: ‘trrz’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_zunger.F:698:58: 698 | + 3.0_dp*tzz*z(1, 0)*z(2, 0) + tz*z(3, 0) | ^ Warning: ‘trrr’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_zunger.F:616:78: 616 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & | ^ note: ‘trrr’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_perdew_zunger.mod' due to: xc_perdew_zunger.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_zunger.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod input_section_types.mod xc_rho_set_types.mod base_hooks.mod xc_functionals_utilities.mod kinds.mod bibliography.mod xc_input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_perdew86.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew86.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod input_section_types.mod xc_rho_set_types.mod base_hooks.mod xc_functionals_utilities.mod kinds.mod xc_perdew_zunger.mod xc_input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew86.F xc_perdew86.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:57:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_perdew86.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_perdew86.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_perdew86.mod' due to: xc_perdew86.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew86.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod input_section_types.mod xc_rho_set_types.mod base_hooks.mod xc_functionals_utilities.mod kinds.mod xc_perdew_zunger.mod xc_input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_xpbe_hole_t_c_lr.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod mathlib.mod mathconstants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F xc_xpbe_hole_t_c_lr.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:57:51 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xpbe_hole_t_c_lr.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xpbe_hole_t_c_lr.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: 1058 | Clda)*sx | ^ Warning: ‘t97’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: ‘t93’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: ‘t91’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: 1090 | *t155)*Clda)*sx | ^ Warning: ‘t89’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1070:24: 1070 | t586 = t86*t225 | ^ Warning: ‘t86’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1020:32: 1020 | t352 = 0.1e1_dp/t85/t33 | ^ Warning: ‘t85’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: 1090 | *t155)*Clda)*sx | ^ Warning: ‘t84’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: Warning: ‘t83’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: 1058 | Clda)*sx | ^ Warning: ‘t81’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1031:23: 1031 | t415 = t79*t21 | ^ Warning: ‘t79’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1066:38: 1066 | t531 = F1*t235*t34 - t77*t529 | ^ Warning: ‘t77’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: 1058 | Clda)*sx | ^ Warning: ‘t75’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1034:23: 1034 | t461 = t74*t21 | ^ Warning: ‘t74’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: 1058 | Clda)*sx | ^ Warning: ‘t7’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: 1090 | *t155)*Clda)*sx | ^ Warning: ‘t65’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: 1058 | Clda)*sx | ^ Warning: ‘t64’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: ‘t6’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: ‘t58’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1008:22: 1008 | t305 = t56**2 | ^ Warning: ‘t56’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: 1058 | Clda)*sx | ^ Warning: ‘t52’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1007:28: 1007 | t299 = 0.1e1_dp/t51 | ^ Warning: ‘t51’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:978:47: 978 | t211 = 0.2e1_dp/0.3e1_dp*t50*t93*t7*t4 | ^ Warning: ‘t50’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: 1090 | *t155)*Clda)*sx | ^ Warning: ‘t45’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: 1058 | Clda)*sx | ^ Warning: ‘t44’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: 1090 | *t155)*Clda)*sx | ^ Warning: ‘t40’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:996:27: 996 | *t37*t248 | ^ Warning: ‘t39’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: 1058 | Clda)*sx | ^ Warning: ‘t38’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: ‘t37’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: ‘t35’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: 1090 | *t155)*Clda)*sx | ^ Warning: ‘t34’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1002:45: 1002 | t280 = 0.1e1_dp/t21*t33*t276*t1*t278 | ^ Warning: ‘t33’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:976:59: 976 | t204 = 4*t193*t185 + 5*t196*t197 + 6*t200*t31*t174 | ^ Warning: ‘t31’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:991:24: 991 | t242 = t27*t225 | ^ Warning: ‘t27’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1028:23: 1028 | t406 = t25*t31 | ^ Warning: ‘t25’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:985:54: 985 | *t41 - 0.9e1_dp/0.4e1_dp*t22*t221*t204 | ^ Warning: ‘t22’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1034:23: 1034 | t461 = t74*t21 | ^ Warning: ‘t21’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:988:24: 988 | t232 = t19*t225 | ^ Warning: ‘t19’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1014:22: 1014 | t330 = g4*t17 | ^ Warning: ‘t17’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: 1058 | Clda)*sx | ^ Warning: ‘t158’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: 1090 | *t155)*Clda)*sx | ^ Warning: ‘t155’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: 1058 | Clda)*sx | ^ Warning: ‘t152’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: ‘t151’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1009:34: 1009 | t307 = 0.1e1_dp/t305*t150 | ^ Warning: ‘t150’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: 1058 | Clda)*sx | ^ Warning: ‘t146’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: ‘t143’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: 1090 | *t155)*Clda)*sx | ^ Warning: ‘t142’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: 1058 | Clda)*sx | ^ Warning: ‘t140’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: 1090 | *t155)*Clda)*sx | ^ Warning: ‘t14’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: 1058 | Clda)*sx | ^ Warning: ‘t138’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: 1090 | *t155)*Clda)*sx | ^ Warning: ‘t135’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: 1058 | Clda)*sx | ^ Warning: ‘t133’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: 1090 | *t155)*Clda)*sx | ^ Warning: ‘t130’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:987:24: 987 | t229 = t13*t225 | ^ Warning: ‘t13’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: 1058 | Clda)*sx | ^ Warning: ‘t127’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: ‘t126’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: ‘t122’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:999:28: 999 | t272 = t268/t12/t13 | ^ Warning: ‘t12’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: 1058 | Clda)*sx | ^ Warning: ‘t119’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: 1090 | *t155)*Clda)*sx | ^ Warning: ‘t118’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: 1058 | Clda)*sx | ^ Warning: ‘t115’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: ‘t113’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: 1090 | *t155)*Clda)*sx | ^ Warning: ‘t110’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:965:23: 965 | t183 = t12*t11 | ^ Warning: ‘t11’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: 1058 | Clda)*sx | ^ Warning: ‘t106’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: 1090 | *t155)*Clda)*sx | ^ Warning: ‘t102’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:653:49: 653 | - 0.9e1_dp/0.4e1_dp*t22*t265*t248 | ^ Warning: ‘t14’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:779:46: 779 | t409*(t281 - t235*t41*t292)) | ^ Warning: ‘t99’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:779:46: Warning: ‘t95’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:696:42: 696 | *(t262 - t235*t41*t248)) | ^ Warning: ‘t94’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:779:46: 779 | t409*(t281 - t235*t41*t292)) | ^ Warning: ‘t93’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:779:46: Warning: ‘t88’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:709:29: 709 | t475 = t473*t87*t218 | ^ Warning: ‘t87’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:701:23: 701 | t429 = t86*t56 | ^ Warning: ‘t86’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:696:42: 696 | *(t262 - t235*t41*t248)) | ^ Warning: ‘t85’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:696:42: Warning: ‘t77’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:722:23: 722 | t541 = t73*t21 | ^ Warning: ‘t73’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:772:38: 772 | t677 = F1*t279*t34 - t71*t675 | ^ Warning: ‘t71’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: 767 | Clda)*sx | ^ Warning: ‘t7’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx | ^ Warning: ‘t65’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: 767 | Clda)*sx | ^ Warning: ‘t64’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: ‘t6’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: ‘t58’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:701:23: 701 | t429 = t86*t56 | ^ Warning: ‘t56’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: 767 | Clda)*sx | ^ Warning: ‘t52’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:779:46: 779 | t409*(t281 - t235*t41*t292)) | ^ Warning: ‘t51’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:645:48: 645 | t255 = 0.2e1_dp/0.3e1_dp*t50*t125*t7*t4 | ^ Warning: ‘t50’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx | ^ Warning: ‘t45’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: 767 | Clda)*sx | ^ Warning: ‘t44’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:628:24: 628 | t217 = t216*t40 | ^ Warning: ‘t40’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:664:27: 664 | *t37*t292 | ^ Warning: ‘t39’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: 767 | Clda)*sx | ^ Warning: ‘t38’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: ‘t37’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: ‘t35’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:658:24: 658 | t280 = t279*t34 | ^ Warning: ‘t34’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:705:33: 705 | t445 = 0.1e1_dp/t117/t33 | ^ Warning: ‘t33’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:720:25: 720 | t533 = t25*t31*C | ^ Warning: ‘t31’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:643:63: 643 | t248 = 4*t237*t229 + 5*t240*t27*t218 + 6*t244*t31*t218 | ^ Warning: ‘t27’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:720:25: 720 | t533 = t25*t31*C | ^ Warning: ‘t25’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:653:49: 653 | - 0.9e1_dp/0.4e1_dp*t22*t265*t248 | ^ Warning: ‘t22’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:715:24: 715 | t504 = t429*t21 | ^ Warning: ‘t21’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: 767 | Clda)*sx | ^ Warning: ‘t202’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx | ^ Warning: ‘t199’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: 767 | Clda)*sx | ^ Warning: ‘t196’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: ‘t195’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:676:34: 676 | t349 = 0.1e1_dp/t347*t194 | ^ Warning: ‘t194’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: 767 | Clda)*sx | ^ Warning: ‘t190’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:704:24: 704 | t437 = t227*t19 | ^ Warning: ‘t19’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx | ^ Warning: ‘t187’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: 767 | Clda)*sx | ^ Warning: ‘t183’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: ‘t181’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx | ^ Warning: ‘t178’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: 767 | Clda)*sx | ^ Warning: ‘t177’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: ‘t176’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx | ^ Warning: ‘t175’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: 767 | Clda)*sx | ^ Warning: ‘t173’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx | ^ Warning: ‘t170’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:641:22: 641 | t240 = a4*t17 | ^ Warning: ‘t17’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: 767 | Clda)*sx | ^ Warning: ‘t167’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: ‘t164’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: ‘t163’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: ‘t159’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: ‘t156’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx | ^ Warning: ‘t155’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: 767 | Clda)*sx | ^ Warning: ‘t152’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: ‘t150’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx | ^ Warning: ‘t147’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: Warning: ‘t144’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:781:25: 781 | t720 = t143*t269 | ^ Warning: ‘t143’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: 767 | Clda)*sx | ^ Warning: ‘t142’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: ‘t140’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx | ^ Warning: ‘t136’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: 767 | Clda)*sx | ^ Warning: ‘t133’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:655:24: 655 | t273 = t13*t269 | ^ Warning: ‘t13’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: 767 | Clda)*sx | ^ Warning: ‘t129’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:644:34: 644 | t251 = t236*t125*t37*t248 | ^ Warning: ‘t125’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: 767 | Clda)*sx | ^ Warning: ‘t123’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx | ^ Warning: ‘t121’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:779:46: 779 | t409*(t281 - t235*t41*t292)) | ^ Warning: ‘t12’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:788:25: 788 | t808 = t118*t269 | ^ Warning: ‘t118’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:705:33: 705 | t445 = 0.1e1_dp/t117/t33 | ^ Warning: ‘t117’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:729:25: 729 | t612 = t429*t116 | ^ Warning: ‘t116’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx | ^ Warning: ‘t115’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: 767 | Clda)*sx | ^ Warning: ‘t113’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:681:23: 681 | t373 = t73*t11 | ^ Warning: ‘t11’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx | ^ Warning: ‘t109’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:710:30: 710 | t479 = t108*t429*t331 | ^ Warning: ‘t108’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:708:25: 708 | t473 = t424*t107 | ^ Warning: ‘t107’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:667:30: 667 | t314 = t312*t106*t107 | ^ Warning: ‘t106’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:726:25: 726 | t603 = t437*t105 | ^ Warning: ‘t105’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:724:29: 724 | t581 = t64*t118*t103 | ^ Warning: ‘t103’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_xpbe_hole_t_c_lr.mod' due to: xc_xpbe_hole_t_c_lr.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod mathlib.mod mathconstants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_pbe.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_pbe.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod input_section_types.mod xc_rho_set_types.mod base_hooks.mod kinds.mod mathconstants.mod bibliography.mod xc_input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_pbe.F xc_pbe.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:57:53 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_pbe.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_pbe.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_pbe.F:1923:38: 1923 | t477 = 0.1e1_dp/t475*mu | ^ Warning: ‘mu’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_pbe.F:1524:25: 1524 | kf_brhobrhob, mu | ^ note: ‘mu’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_pbe.F:1735:51: 1735 | Fx_b = 0.1e1_dp + kappa - kappa/t153 | ^ Warning: ‘kappa’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_pbe.F:1523:42: 1523 | k_s1rhob, k_srhoa, k_srhob, kappa, kf_a, kf_arhoa, kf_arhoarhoa, kf_b, kf_brhob, & | ^ note: ‘kappa’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_pbe.F:1692:31: 1692 | t101 = beta*t100 | ^ Warning: ‘beta’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_pbe.F:1512:24: 1512 | Arhobrhob, beta, beta_1_1, beta_1_2, beta_1_3, beta_2_1, beta_2_2, beta_2_3, beta_3_1, & | ^ note: ‘beta’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_pbe.F:1108:55: 1108 | t1385 = 0.1e1_dp/t1380*t469*mu*t101*s | ^ Warning: ‘mu’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_pbe.F:431:24: 431 | kfrhorhorho, mu, my_norm_drho, my_rho, p_1, p_2, rs, rs2rho, rsrho, rsrhorho, & | ^ note: ‘mu’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_pbe.F:1109:34: 1109 | t1386 = kappa**2 | ^ Warning: ‘kappa’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_pbe.F:430:66: 430 | k_s1rhorho, k_s2rho, k_srho, k_srho1rho, k_srhorho, kappa, kf, kf2rho, kfrho, kfrhorho, & | ^ note: ‘kappa’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_pbe.F:956:34: 956 | t879 = beta/t877 | ^ Warning: ‘beta’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_pbe.F:423:25: 423 | Arhorhorho, beta, beta_1_1, beta_2_1, beta_3_1, beta_4_1, e_c_u_0, e_c_u_01rho, & | ^ note: ‘beta’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_pbe.mod' due to: xc_pbe.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_pbe.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod input_section_types.mod xc_rho_set_types.mod base_hooks.mod kinds.mod mathconstants.mod bibliography.mod xc_input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_pade.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_pade.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod base_hooks.mod xc_functionals_utilities.mod kinds.mod bibliography.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_pade.F xc_pade.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:57:58 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_pade.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_pade.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_pade.mod' due to: xc_pade.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_pade.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod base_hooks.mod xc_functionals_utilities.mod kinds.mod bibliography.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_optx.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_optx.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_array_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_optx.F xc_optx.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:58:00 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_optx.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_optx.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_optx.mod' due to: xc_optx.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_optx.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_array_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_exchange_gga.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_exchange_gga.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod base_hooks.mod xc_functionals_utilities.mod cp_log_handling.mod kinds.mod cp_array_utils.mod mathconstants.mod xc_input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_exchange_gga.F xc_exchange_gga.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:58:01 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_exchange_gga.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_exchange_gga.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_exchange_gga.mod' due to: xc_exchange_gga.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_exchange_gga.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod base_hooks.mod xc_functionals_utilities.mod cp_log_handling.mod kinds.mod cp_array_utils.mod mathconstants.mod xc_input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_perdew_wang.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod base_hooks.mod xc_functionals_utilities.mod kinds.mod xc_input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.F xc_perdew_wang.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:58:05 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_perdew_wang.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_perdew_wang.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.F:632:65: 632 | + trz*r(1)*z(0, 2) + tzz*z(0, 2)*z(1, 0) + tz*z(1, 2) | ^ Warning: ‘tzz’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.F:496:63: 496 | tzz, tzzz | ^ note: ‘tzz’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.F:603:56: 603 | + tr*r(2) + tzz*z(1, 0)**2 + tz*z(2, 0) | ^ Warning: ‘trz’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.F:495:89: 495 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & | ^ note: ‘trz’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.F:603:56: 603 | + tr*r(2) + tzz*z(1, 0)**2 + tz*z(2, 0) | ^ Warning: ‘trr’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.F:495:72: 495 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & | ^ note: ‘trr’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.F:495:99: 495 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & | ^ Warning: ‘tz’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.F:597:37: 597 | ed(m) = tr*r(1) + tz*z(1, 0) | ^ Warning: ‘tr’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.F:495:67: 495 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & | ^ note: ‘tr’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.F:638:53: 638 | + 3.0_dp*tzz*z(0, 1)*z(0, 2) + tz*z(0, 3) | ^ Warning: ‘tzzz’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.F:496:69: 496 | tzz, tzzz | ^ note: ‘tzzz’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.F:624:65: 624 | + trz*r(1)*z(2, 0) + tzz*z(2, 0)*z(0, 1) + tz*z(2, 1) | ^ Warning: ‘trzz’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.F:495:95: 495 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & | ^ note: ‘trzz’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.F:616:53: 616 | + 3.0_dp*tzz*z(1, 0)*z(2, 0) + tz*z(3, 0) | ^ Warning: ‘trrz’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.F:495:84: 495 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & | ^ note: ‘trrz’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.F:616:53: 616 | + 3.0_dp*tzz*z(1, 0)*z(2, 0) + tz*z(3, 0) | ^ Warning: ‘trrr’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.F:495:78: 495 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & | ^ note: ‘trrr’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_perdew_wang.mod' due to: xc_perdew_wang.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod base_hooks.mod xc_functionals_utilities.mod kinds.mod xc_input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_xbecke88_long_range.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_array_utils.mod mathconstants.mod bibliography.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F xc_xbecke88_long_range.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:58:07 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xbecke88_long_range.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xbecke88_long_range.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1427:67: 1427 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 | ^ Warning: ‘t98’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1057:72: 1057 | t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961, t98 | ^ note: ‘t98’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1261:104: 1261 | *t68*t259 - 0.2222222224e0_dp*t24*t98*t358)*sx | ^ Warning: ‘t95’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1057:61: 1057 | t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961, t98 | ^ note: ‘t95’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1313:70: 1313 | *t117*t297*t172 + 0.3333333334e0_dp*t36*t38*t492 | ^ Warning: ‘t94’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1057:56: 1057 | t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961, t98 | ^ note: ‘t94’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1276:72: 1276 | *t11*t91 + 0.40e1_dp*t382*t384 - 0.20e1_dp*t6*t401 | ^ Warning: ‘t91’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1057:45: 1057 | t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961, t98 | ^ note: ‘t91’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1202:30: 1202 | t226 = t225*t90 | ^ Warning: ‘t90’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1057:40: 1057 | t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961, t98 | ^ note: ‘t90’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1273:55: 1273 | t87 + 0.8000000000e1_dp*t393*t397 | ^ Warning: ‘t87’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1057:29: 1057 | t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961, t98 | ^ note: ‘t87’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1328:66: 1328 | t525 = 0.120e2_dp*t508*t86 - 0.60e1_dp*t6*t521*t250 | ^ Warning: ‘t86’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1057:12: 1057 | t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961, t98 | ^ note: ‘t86’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1375:39: 1375 | t669 = 0.1e1_dp/t85/t667 | ^ Warning: ‘t85’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1056:89: 1056 | t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, t857, & | ^ note: ‘t85’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1374:28: 1374 | t667 = t84**2 | ^ Warning: ‘t84’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1056:72: 1056 | t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, t857, & | ^ note: ‘t84’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1159:28: 1159 | t140 = t8*rho | ^ Warning: ‘t8’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1056:61: 1056 | t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, t857, & | ^ note: ‘t8’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1393:67: 1393 | *t128*t43*t677 - 0.2666666667e1_dp*t42*pi*t79 | ^ Warning: ‘t79’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1056:45: 1056 | t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, t857, & | ^ note: ‘t79’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1215:30: 1215 | t255 = t77*t254 | ^ Warning: ‘t77’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1056:40: 1056 | t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, t857, & | ^ note: ‘t77’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) | ^ Warning: ‘t76’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1056:29: 1056 | t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, t857, & | ^ note: ‘t76’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1370:28: 1370 | t639 = t75**2 | ^ Warning: ‘t75’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1056:24: 1056 | t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, t857, & | ^ note: ‘t75’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1276:72: 1276 | *t11*t91 + 0.40e1_dp*t382*t384 - 0.20e1_dp*t6*t401 | ^ Warning: ‘t72’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1055:84: 1055 | t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, t735, & | ^ note: ‘t72’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: 1442 | *t244*ndrho/t657/t7*t669) | ^ Warning: ‘t71’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1055:73: 1055 | t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, t735, & | ^ note: ‘t71’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1120:27: 1120 | t69 = t7*rho | ^ Warning: ‘t7’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1055:68: 1055 | t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, t735, & | ^ note: ‘t7’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1382:63: 1382 | /t69*t669) | ^ Warning: ‘t69’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1055:64: 1055 | t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, t735, & | ^ note: ‘t69’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1494:76: 1494 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) | ^ Warning: ‘t68’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1055:53: 1055 | t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, t735, & | ^ note: ‘t68’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: 1553 | t98*t1400 | ^ Warning: ‘t64’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1055:12: 1055 | t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, t735, & | ^ note: ‘t64’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1172:84: 1172 | 0.2222222224e0_dp*t24*t98*t155)*sx | ^ Warning: ‘t60’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1054:45: 1054 | t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, t639, & | ^ note: ‘t60’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) | ^ Warning: ‘t6’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1054:40: 1054 | t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, t639, & | ^ note: ‘t6’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1498:31: 1498 | t1153 = t27*t590 | ^ Warning: ‘t590’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1054:36: 1054 | t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, t639, & | ^ note: ‘t590’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1494:76: 1494 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) | ^ Warning: ‘t59’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1054:30: 1054 | t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, t639, & | ^ note: ‘t59’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: 1544 | *t36*t38*t1396 | ^ Warning: ‘t586’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1054:25: 1054 | t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, t639, & | ^ note: ‘t586’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 | ^ Warning: ‘t580’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1054:19: 1054 | t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, t639, & | ^ note: ‘t580’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: 1544 | *t36*t38*t1396 | ^ Warning: ‘t576’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1054:13: 1054 | t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, t639, & | ^ note: ‘t576’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t575’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:96: 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & | ^ note: ‘t575’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: 1544 | *t36*t38*t1396 | ^ Warning: ‘t574’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:90: 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & | ^ note: ‘t574’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 | ^ Warning: ‘t573’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:84: 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & | ^ note: ‘t573’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t572’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:78: 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & | ^ note: ‘t572’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t571’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:72: 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & | ^ note: ‘t571’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t570’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:66: 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & | ^ note: ‘t570’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: 1544 | *t36*t38*t1396 | ^ Warning: ‘t566’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:60: 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & | ^ note: ‘t566’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: 1544 | *t36*t38*t1396 | ^ Warning: ‘t562’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:54: 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & | ^ note: ‘t562’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1169:26: 1169 | t151 | ^ Warning: ‘t55’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:48: 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & | ^ note: ‘t55’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t539’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:43: 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & | ^ note: ‘t539’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t537’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:37: 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & | ^ note: ‘t537’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t536’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:31: 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & | ^ note: ‘t536’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: 1553 | t98*t1400 | ^ Warning: ‘t530’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:13: 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & | ^ note: ‘t530’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1586:49: 1586 | *sx | ^ Warning: ‘t529’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:93: 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & | ^ note: ‘t529’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) | ^ Warning: ‘t526’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:87: 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & | ^ note: ‘t526’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) | ^ Warning: ‘t525’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:81: 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & | ^ note: ‘t525’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) | ^ Warning: ‘t521’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:75: 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & | ^ note: ‘t521’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1184:59: 1184 | *t52 - 0.5000000001e0_dp*t41*t172*t46 | ^ Warning: ‘t52’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:69: 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & | ^ note: ‘t52’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1367:38: 1367 | t624 = 0.1e1_dp/t8/t519 | ^ Warning: ‘t519’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:64: 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & | ^ note: ‘t519’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) | ^ Warning: ‘t514’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:58: 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & | ^ note: ‘t514’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) | ^ Warning: ‘t513’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:52: 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & | ^ note: ‘t513’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1244:33: 1244 | t339 = t48*t10*t51 | ^ Warning: ‘t51’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:46: 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & | ^ note: ‘t51’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) | ^ Warning: ‘t508’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:41: 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & | ^ note: ‘t508’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: 1553 | t98*t1400 | ^ Warning: ‘t505’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:35: 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & | ^ note: ‘t505’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: 1553 | t98*t1400 | ^ Warning: ‘t502’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:29: 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & | ^ note: ‘t502’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1586:49: 1586 | *sx | ^ Warning: ‘t501’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:23: 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & | ^ note: ‘t501’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1382:63: 1382 | /t69*t669) | ^ Warning: ‘t5’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:17: 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & | ^ note: ‘t5’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1431:30: 1431 | t857 = t27*t496 | ^ Warning: ‘t496’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:13: 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & | ^ note: ‘t496’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1485:76: 1485 | + t1136) | ^ Warning: ‘t492’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:96: 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & | ^ note: ‘t492’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: 1456 | - 0.1111111111e0_dp*t117*t293*t404 | ^ Warning: ‘t49’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:90: 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & | ^ note: ‘t49’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 | ^ Warning: ‘t489’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:85: 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & | ^ note: ‘t489’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 | ^ Warning: ‘t486’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:79: 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & | ^ note: ‘t486’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 | ^ Warning: ‘t482’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:73: 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & | ^ note: ‘t482’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 | ^ Warning: ‘t479’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:62: 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & | ^ note: ‘t479’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1470:68: 1470 | *t335*t486 - 0.1000000001e1_dp*t94*t135*t1091 | ^ Warning: ‘t478’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:56: 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & | ^ note: ‘t478’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 | ^ Warning: ‘t473’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:50: 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & | ^ note: ‘t473’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1470:68: 1470 | *t335*t486 - 0.1000000001e1_dp*t94*t135*t1091 | ^ Warning: ‘t470’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:44: 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & | ^ note: ‘t470’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1406:40: 1406 | REAL(t46, KIND=dp) | ^ Warning: ‘t47’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:38: 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & | ^ note: ‘t47’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 | ^ Warning: ‘t467’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:33: 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & | ^ note: ‘t467’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t466’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:27: 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & | ^ note: ‘t466’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 | ^ Warning: ‘t465’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:71: 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 | ^ note: ‘t465’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 | ^ Warning: ‘t464’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:65: 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 | ^ note: ‘t464’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: 1477 | t41*t328*t466 | ^ Warning: ‘t463’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:59: 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 | ^ note: ‘t463’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: 1477 | t41*t328*t466 | ^ Warning: ‘t462’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:53: 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 | ^ note: ‘t462’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: 1456 | - 0.1111111111e0_dp*t117*t293*t404 | ^ Warning: ‘t460’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:47: 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 | ^ note: ‘t460’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1184:59: 1184 | *t52 - 0.5000000001e0_dp*t41*t172*t46 | ^ Warning: ‘t46’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:41: 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 | ^ note: ‘t46’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: 1456 | - 0.1111111111e0_dp*t117*t293*t404 | ^ Warning: ‘t457’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:36: 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 | ^ note: ‘t457’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: 1456 | - 0.1111111111e0_dp*t117*t293*t404 | ^ Warning: ‘t455’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:30: 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 | ^ note: ‘t455’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1514:57: 1514 | + 0.5999999999e1_dp*t128*t132*t529 | ^ Warning: ‘t452’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:24: 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 | ^ note: ‘t452’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t451’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:18: 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 | ^ note: ‘t451’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1139:49: 1139 | t103 = EXP(-0.9000000000e1_dp*t44) | ^ Warning: ‘t44’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:12: 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 | ^ note: ‘t44’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: 1544 | *t36*t38*t1396 | ^ Warning: ‘t435’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:94: 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & | ^ note: ‘t435’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1153:34: 1153 | t130 = t128*t43*t94 | ^ Warning: ‘t43’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:88: 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & | ^ note: ‘t43’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: 1544 | *t36*t38*t1396 | ^ Warning: ‘t429’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:83: 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & | ^ note: ‘t429’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: 1456 | - 0.1111111111e0_dp*t117*t293*t404 | ^ Warning: ‘t428’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:77: 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & | ^ note: ‘t428’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1155:30: 1155 | t133 = t42*t132 | ^ Warning: ‘t42’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:71: 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & | ^ note: ‘t42’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: 1544 | *t36*t38*t1396 | ^ Warning: ‘t418’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:66: 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & | ^ note: ‘t418’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: 1456 | - 0.1111111111e0_dp*t117*t293*t404 | ^ Warning: ‘t417’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:60: 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & | ^ note: ‘t417’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: 1544 | *t36*t38*t1396 | ^ Warning: ‘t413’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:54: 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & | ^ note: ‘t413’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1304:30: 1304 | t489 = t41*t135 | ^ Warning: ‘t41’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:42: 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & | ^ note: ‘t41’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1494:76: 1494 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) | ^ Warning: ‘t408’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:37: 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & | ^ note: ‘t408’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1494:76: 1494 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) | ^ Warning: ‘t405’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:31: 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & | ^ note: ‘t405’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: 1553 | t98*t1400 | ^ Warning: ‘t404’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:25: 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & | ^ note: ‘t404’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) | ^ Warning: ‘t401’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:19: 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & | ^ note: ‘t401’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) | ^ Warning: ‘t400’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:13: 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & | ^ note: ‘t400’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1152:30: 1152 | t128 = t40*t127 | ^ Warning: ‘t40’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:92: 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & | ^ note: ‘t40’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) | ^ Warning: ‘t397’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:87: 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & | ^ note: ‘t397’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) | ^ Warning: ‘t393’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:81: 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & | ^ note: ‘t393’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1158:29: 1158 | t137 = t39*t94 | ^ Warning: ‘t39’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:75: 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & | ^ note: ‘t39’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) | ^ Warning: ‘t384’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:70: 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & | ^ note: ‘t384’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) | ^ Warning: ‘t383’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:64: 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & | ^ note: ‘t383’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: 1442 | *t244*ndrho/t657/t7*t669) | ^ Warning: ‘t382’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:58: 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & | ^ note: ‘t382’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1257:68: 1257 | t36*t122*t151 + 0.3333333334e0_dp*t36*t38*t354 | ^ Warning: ‘t38’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:52: 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & | ^ note: ‘t38’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) | ^ Warning: ‘t377’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:47: 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & | ^ note: ‘t377’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1494:76: 1494 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) | ^ Warning: ‘t372’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:41: 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & | ^ note: ‘t372’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1286:30: 1286 | t435 = t37*t196 | ^ Warning: ‘t37’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:35: 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & | ^ note: ‘t37’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: 1553 | t98*t1400 | ^ Warning: ‘t368’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:30: 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & | ^ note: ‘t368’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: 1553 | t98*t1400 | ^ Warning: ‘t365’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:24: 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & | ^ note: ‘t365’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: 1553 | t98*t1400 | ^ Warning: ‘t36’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:18: 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & | ^ note: ‘t36’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1363:30: 1363 | t601 = t27*t358 | ^ Warning: ‘t358’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:13: 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & | ^ note: ‘t358’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1421:54: 1421 | + 0.3333333334e0_dp*t36*t38*t838 | ^ Warning: ‘t354’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:96: 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & | ^ note: ‘t354’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: 1477 | t41*t328*t466 | ^ Warning: ‘t351’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:90: 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & | ^ note: ‘t351’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: 1477 | t41*t328*t466 | ^ Warning: ‘t347’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:84: 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & | ^ note: ‘t347’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1406:40: 1406 | REAL(t46, KIND=dp) | ^ Warning: ‘t346’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:78: 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & | ^ note: ‘t346’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: 1477 | t41*t328*t466 | ^ Warning: ‘t343’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:72: 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & | ^ note: ‘t343’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: 1477 | t41*t328*t466 | ^ Warning: ‘t339’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:61: 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & | ^ note: ‘t339’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1470:68: 1470 | *t335*t486 - 0.1000000001e1_dp*t94*t135*t1091 | ^ Warning: ‘t335’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:55: 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & | ^ note: ‘t335’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1406:40: 1406 | REAL(t46, KIND=dp) | ^ Warning: ‘t330’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:49: 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & | ^ note: ‘t330’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: 1477 | t41*t328*t466 | ^ Warning: ‘t328’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:43: 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & | ^ note: ‘t328’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: 1477 | t41*t328*t466 | ^ Warning: ‘t326’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:37: 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & | ^ note: ‘t326’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1421:54: 1421 | + 0.3333333334e0_dp*t36*t38*t838 | ^ Warning: ‘t325’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:31: 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & | ^ note: ‘t325’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1463:38: 1463 | *t128*t323*t172 | ^ Warning: ‘t323’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:25: 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & | ^ note: ‘t323’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1421:54: 1421 | + 0.3333333334e0_dp*t36*t38*t838 | ^ Warning: ‘t321’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:19: 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & | ^ note: ‘t321’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1421:54: 1421 | + 0.3333333334e0_dp*t36*t38*t838 | ^ Warning: ‘t319’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:13: 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & | ^ note: ‘t319’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1421:54: 1421 | + 0.3333333334e0_dp*t36*t38*t838 | ^ Warning: ‘t316’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:97: 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & | ^ note: ‘t316’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: 1544 | *t36*t38*t1396 | ^ Warning: ‘t313’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:91: 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & | ^ note: ‘t313’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 | ^ Warning: ‘t312’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:85: 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & | ^ note: ‘t312’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1226:31: 1226 | *t30*t281 | ^ Warning: ‘t31’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:73: 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & | ^ note: ‘t31’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1485:76: 1485 | + t1136) | ^ Warning: ‘t304’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:68: 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & | ^ note: ‘t304’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1144:26: 1144 | t109 | ^ Warning: ‘t30’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:62: 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & | ^ note: ‘t30’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1229:28: 1229 | t293 = t3*t55 | ^ Warning: ‘t3’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:57: 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & | ^ note: ‘t3’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: 1544 | *t36*t38*t1396 | ^ Warning: ‘t297’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:53: 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & | ^ note: ‘t297’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: 1544 | *t36*t38*t1396 | ^ Warning: ‘t293’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:47: 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & | ^ note: ‘t293’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1194:35: 1194 | t211 = rho*t29*omega | ^ Warning: ‘t29’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:41: 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & | ^ note: ‘t29’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: 1544 | *t36*t38*t1396 | ^ Warning: ‘t289’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:36: 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & | ^ note: ‘t289’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: 1456 | - 0.1111111111e0_dp*t117*t293*t404 | ^ Warning: ‘t285’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:30: 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & | ^ note: ‘t285’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1421:54: 1421 | + 0.3333333334e0_dp*t36*t38*t838 | ^ Warning: ‘t284’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:24: 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & | ^ note: ‘t284’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: 1456 | - 0.1111111111e0_dp*t117*t293*t404 | ^ Warning: ‘t281’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:18: 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & | ^ note: ‘t281’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1141:30: 1141 | t105 = t28*t104 | ^ Warning: ‘t28’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:12: 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & | ^ note: ‘t28’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: 1544 | *t36*t38*t1396 | ^ Warning: ‘t271’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:95: 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & | ^ note: ‘t271’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t270’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:89: 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & | ^ note: ‘t270’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: 1456 | - 0.1111111111e0_dp*t117*t293*t404 | ^ Warning: ‘t265’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:78: 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & | ^ note: ‘t265’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: 1456 | - 0.1111111111e0_dp*t117*t293*t404 | ^ Warning: ‘t264’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:72: 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & | ^ note: ‘t264’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1427:67: 1427 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 | ^ Warning: ‘t259’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:61: 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & | ^ note: ‘t259’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1494:76: 1494 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) | ^ Warning: ‘t258’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:55: 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & | ^ note: ‘t258’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: 1442 | *t244*ndrho/t657/t7*t669) | ^ Warning: ‘t255’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:49: 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & | ^ note: ‘t255’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: 1442 | *t244*ndrho/t657/t7*t669) | ^ Warning: ‘t254’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:43: 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & | ^ note: ‘t254’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: 1442 | *t244*ndrho/t657/t7*t669) | ^ Warning: ‘t251’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:37: 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & | ^ note: ‘t251’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) | ^ Warning: ‘t250’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:31: 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & | ^ note: ‘t250’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) | ^ Warning: ‘t245’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:25: 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & | ^ note: ‘t245’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: 1442 | *t244*ndrho/t657/t7*t669) | ^ Warning: ‘t244’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:19: 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & | ^ note: ‘t244’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: 1442 | *t244*ndrho/t657/t7*t669) | ^ Warning: ‘t241’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:13: 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & | ^ note: ‘t241’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1427:67: 1427 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 | ^ Warning: ‘t24’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:96: 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & | ^ note: ‘t24’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: 1442 | *t244*ndrho/t657/t7*t669) | ^ Warning: ‘t237’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:91: 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & | ^ note: ‘t237’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: 1442 | *t244*ndrho/t657/t7*t669) | ^ Warning: ‘t233’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:85: 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & | ^ note: ‘t233’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: 1442 | *t244*ndrho/t657/t7*t669) | ^ Warning: ‘t232’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:79: 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & | ^ note: ‘t232’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) | ^ Warning: ‘t230’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:67: 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & | ^ note: ‘t230’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1140:34: 1140 | t104 = 0.1e1_dp/t23 | ^ Warning: ‘t23’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:61: 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & | ^ note: ‘t23’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: 1442 | *t244*ndrho/t657/t7*t669) | ^ Warning: ‘t226’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:56: 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & | ^ note: ‘t226’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) | ^ Warning: ‘t225’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:50: 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & | ^ note: ‘t225’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: 1442 | *t244*ndrho/t657/t7*t669) | ^ Warning: ‘t222’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:44: 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & | ^ note: ‘t222’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1368:30: 1368 | t628 = t221*t76 | ^ Warning: ‘t221’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:38: 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & | ^ note: ‘t221’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1119:34: 1119 | t68 = rho*t22*omega | ^ Warning: ‘t22’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:32: 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & | ^ note: ‘t22’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1382:63: 1382 | /t69*t669) | ^ Warning: ‘t219’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:27: 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & | ^ note: ‘t219’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1427:67: 1427 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 | ^ Warning: ‘t216’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:70: 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 | ^ note: ‘t216’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1427:67: 1427 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 | ^ Warning: ‘t213’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:64: 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 | ^ note: ‘t213’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1494:76: 1494 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) | ^ Warning: ‘t212’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:58: 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 | ^ note: ‘t212’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1494:76: 1494 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) | ^ Warning: ‘t211’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:52: 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 | ^ note: ‘t211’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1232:30: 1232 | t311 = t126*t21 | ^ Warning: ‘t21’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:46: 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 | ^ note: ‘t21’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: 1553 | t98*t1400 | ^ Warning: ‘t207’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:41: 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 | ^ note: ‘t207’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1263:30: 1263 | t365 = t27*t200 | ^ Warning: ‘t200’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:35: 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 | ^ note: ‘t200’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1346:29: 1346 | t576 = t2*t501 | ^ Warning: ‘t2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:29: 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 | ^ note: ‘t2’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1313:70: 1313 | *t117*t297*t172 + 0.3333333334e0_dp*t36*t38*t492 | ^ Warning: ‘t196’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:25: 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 | ^ note: ‘t196’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: 1477 | t41*t328*t466 | ^ Warning: ‘t190’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:19: 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 | ^ note: ‘t190’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t186’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:13: 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 | ^ note: ‘t186’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t185’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:96: 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & | ^ note: ‘t185’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1176:59: 1176 | t172 = 0.40e1_dp*t11*t18 - 0.20e1_dp*t6*t169 | ^ Warning: ‘t18’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:90: 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & | ^ note: ‘t18’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t177’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:85: 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & | ^ note: ‘t177’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1318:79: 1318 | *t24*t98*t496)*sx | ^ Warning: ‘t173’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:73: 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & | ^ note: ‘t173’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1355:35: 1355 | *t36*t38*t586 | ^ Warning: ‘t172’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:67: 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & | ^ note: ‘t172’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1122:28: 1122 | t72 = t71*t17 | ^ Warning: ‘t17’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:61: 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & | ^ note: ‘t17’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1331:41: 1331 | - 0.20e1_dp*t6*t526 | ^ Warning: ‘t169’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:56: 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & | ^ note: ‘t169’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1266:31: 1266 | t377 = t225*t168 | ^ Warning: ‘t168’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:50: 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & | ^ note: ‘t168’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1203:38: 1203 | t230 = 0.1e1_dp/t75/t16 | ^ Warning: ‘t16’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:44: 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & | ^ note: ‘t16’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1193:30: 1193 | t207 = t27*t155 | ^ Warning: ‘t155’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:32: 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & | ^ note: ‘t155’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1257:68: 1257 | t36*t122*t151 + 0.3333333334e0_dp*t36*t38*t354 | ^ Warning: ‘t151’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:26: 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & | ^ note: ‘t151’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1308:82: 1308 | - 0.5555555558e-1_dp*t146*t486 - 0.5000000001e0_dp*t489*t466 | ^ Warning: ‘t148’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:20: 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & | ^ note: ‘t148’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: 1477 | t41*t328*t466 | ^ Warning: ‘t147’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1041:93: 1041 | t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, t147, & | ^ note: ‘t147’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: 1477 | t41*t328*t466 | ^ Warning: ‘t146’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1041:80: 1041 | t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, t147, & | ^ note: ‘t146’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1308:82: 1308 | - 0.5555555558e-1_dp*t146*t486 - 0.5000000001e0_dp*t489*t466 | ^ Warning: ‘t143’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1041:60: 1041 | t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, t147, & | ^ note: ‘t143’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1245:35: 1245 | t343 = t141*t135*t46 | ^ Warning: ‘t141’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1041:47: 1041 | t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, t147, & | ^ note: ‘t141’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t140’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1041:20: 1041 | t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, t147, & | ^ note: ‘t140’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1406:40: 1406 | REAL(t46, KIND=dp) | ^ Warning: ‘t137’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:89: 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & | ^ note: ‘t137’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1470:68: 1470 | *t335*t486 - 0.1000000001e1_dp*t94*t135*t1091 | ^ Warning: ‘t136’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:83: 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & | ^ note: ‘t136’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1304:30: 1304 | t489 = t41*t135 | ^ Warning: ‘t135’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:77: 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & | ^ note: ‘t135’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1219:69: 1219 | t264 = 0.9000000000e1_dp*t130 - 0.6000000000e1_dp*t133 | ^ Warning: ‘t133’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:50: 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & | ^ note: ‘t133’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1514:57: 1514 | + 0.5999999999e1_dp*t128*t132*t529 | ^ Warning: ‘t132’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:44: 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & | ^ note: ‘t132’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1219:69: 1219 | t264 = 0.9000000000e1_dp*t130 - 0.6000000000e1_dp*t133 | ^ Warning: ‘t130’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:38: 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & | ^ note: ‘t130’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1237:35: 1237 | t321 = t128*t43*t258 | ^ Warning: ‘t128’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:25: 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & | ^ note: ‘t128’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1299:30: 1299 | t473 = t94*t127 | ^ Warning: ‘t127’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:19: 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & | ^ note: ‘t127’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1232:30: 1232 | t311 = t126*t21 | ^ Warning: ‘t126’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:13: 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & | ^ note: ‘t126’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1313:70: 1313 | *t117*t297*t172 + 0.3333333334e0_dp*t36*t38*t492 | ^ Warning: ‘t122’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1039:85: 1039 | t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, t1220, & | ^ note: ‘t122’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1174:67: 1174 | t168 = 0.60e1_dp*beta*t3*t12 + 0.60e1_dp*t11*t10*t86 | ^ Warning: ‘t12’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1039:79: 1039 | t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, t1220, & | ^ note: ‘t12’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1257:68: 1257 | t36*t122*t151 + 0.3333333334e0_dp*t36*t38*t354 | ^ Warning: ‘t118’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1039:74: 1039 | t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, t1220, & | ^ note: ‘t118’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: 1544 | *t36*t38*t1396 | ^ Warning: ‘t117’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1039:61: 1039 | t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, t1220, & | ^ note: ‘t117’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: 1553 | t98*t1400 | ^ Warning: ‘t116’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1039:41: 1039 | t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, t1220, & | ^ note: ‘t116’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: 1544 | *t36*t38*t1396 | ^ Warning: ‘t113’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1038:89: 1038 | t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, t1136, & | ^ note: ‘t113’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: 1456 | - 0.1111111111e0_dp*t117*t293*t404 | ^ Warning: ‘t112’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1038:83: 1038 | t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, t1136, & | ^ note: ‘t112’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) | ^ Warning: ‘t11’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1038:70: 1038 | t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, t1136, & | ^ note: ‘t11’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1284:66: 1284 | *t31*t404 - 0.5000000000e0_dp*t105*t109*t172 | ^ Warning: ‘t109’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1038:58: 1038 | t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, t1136, & | ^ note: ‘t109’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1355:35: 1355 | *t36*t38*t586 | ^ Warning: ‘t105’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1038:45: 1038 | t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, t1136, & | ^ note: ‘t105’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1364:36: 1364 | t605 = rho*t104*omega | ^ Warning: ‘t104’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1038:32: 1038 | t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, t1136, & | ^ note: ‘t104’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1355:35: 1355 | *t36*t38*t586 | ^ Warning: ‘t103’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1038:26: 1038 | t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, t1136, & | ^ note: ‘t103’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1174:67: 1174 | t168 = 0.60e1_dp*beta*t3*t12 + 0.60e1_dp*t11*t10*t86 | ^ Warning: ‘t10’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1037:77: 1037 | REAL(kind=dp) :: Cx, epsilon_rho43, my_epsilon_rho, ndrho, rho, t1, t10, t100, t1002, t1009, & | ^ note: ‘t10’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1186:69: 1186 | t117*t118*t172 + 0.3333333334e0_dp*t36*t38*t196 | ^ Warning: ‘t1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1037:72: 1037 | REAL(kind=dp) :: Cx, epsilon_rho43, my_epsilon_rho, ndrho, rho, t1, t10, t100, t1002, t1009, & | ^ note: ‘t1’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:658:67: 658 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 | ^ Warning: ‘t98’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:287:26: 287 | REAL(kind=dp) :: t98, t99, xx | ^ note: ‘t98’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:492:94: 492 | *t68*t259 - 0.2222222224e0_dp*t24*t98*t358)*sx | ^ Warning: ‘t95’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:286:67: 286 | t857, t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961 | ^ note: ‘t95’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:544:70: 544 | *t117*t297*t172 + 0.3333333334e0_dp*t36*t38*t492 | ^ Warning: ‘t94’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:286:62: 286 | t857, t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961 | ^ note: ‘t94’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:507:72: 507 | *t11*t91 + 0.40e1_dp*t382*t384 - 0.20e1_dp*t6*t401 | ^ Warning: ‘t91’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:286:51: 286 | t857, t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961 | ^ note: ‘t91’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:433:30: 433 | t226 = t225*t90 | ^ Warning: ‘t90’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:286:46: 286 | t857, t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961 | ^ note: ‘t90’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:504:55: 504 | t87 + 0.8000000000e1_dp*t393*t397 | ^ Warning: ‘t87’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:286:35: 286 | t857, t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961 | ^ note: ‘t87’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:559:66: 559 | t525 = 0.120e2_dp*t508*t86 - 0.60e1_dp*t6*t521*t250 | ^ Warning: ‘t86’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:286:18: 286 | t857, t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961 | ^ note: ‘t86’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:606:39: 606 | t669 = 0.1e1_dp/t85/t667 | ^ Warning: ‘t85’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:285:95: 285 | t735, t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, & | ^ note: ‘t85’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:605:28: 605 | t667 = t84**2 | ^ Warning: ‘t84’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:285:78: 285 | t735, t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, & | ^ note: ‘t84’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:390:31: 390 | t140 = t8*my_rho | ^ Warning: ‘t8’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:285:67: 285 | t735, t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, & | ^ note: ‘t8’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:624:67: 624 | *t128*t43*t677 - 0.2666666667e1_dp*t42*pi*t79 | ^ Warning: ‘t79’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:285:51: 285 | t735, t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, & | ^ note: ‘t79’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:446:30: 446 | t255 = t77*t254 | ^ Warning: ‘t77’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:285:46: 285 | t735, t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, & | ^ note: ‘t77’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) | ^ Warning: ‘t76’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:285:35: 285 | t735, t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, & | ^ note: ‘t76’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:601:28: 601 | t639 = t75**2 | ^ Warning: ‘t75’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:285:30: 285 | t735, t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, & | ^ note: ‘t75’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:507:72: 507 | *t11*t91 + 0.40e1_dp*t382*t384 - 0.20e1_dp*t6*t401 | ^ Warning: ‘t72’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:284:90: 284 | t639, t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, & | ^ note: ‘t72’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: 673 | *t244*my_ndrho/t657/t7*t669) | ^ Warning: ‘t71’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:284:79: 284 | t639, t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, & | ^ note: ‘t71’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:351:30: 351 | t69 = t7*my_rho | ^ Warning: ‘t7’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:284:74: 284 | t639, t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, & | ^ note: ‘t7’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:613:63: 613 | /t69*t669) | ^ Warning: ‘t69’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:284:70: 284 | t639, t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, & | ^ note: ‘t69’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:725:76: 725 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) | ^ Warning: ‘t68’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:284:59: 284 | t639, t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, & | ^ note: ‘t68’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: 784 | t98*t1400 | ^ Warning: ‘t64’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:284:18: 284 | t639, t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, & | ^ note: ‘t64’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:403:74: 403 | 0.2222222224e0_dp*t24*t98*t155)*sx | ^ Warning: ‘t60’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:283:51: 283 | t575, t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, & | ^ note: ‘t60’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) | ^ Warning: ‘t6’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:283:46: 283 | t575, t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, & | ^ note: ‘t6’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:729:31: 729 | t1153 = t27*t590 | ^ Warning: ‘t590’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:283:42: 283 | t575, t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, & | ^ note: ‘t590’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:725:76: 725 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) | ^ Warning: ‘t59’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:283:36: 283 | t575, t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, & | ^ note: ‘t59’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: 775 | *t36*t38*t1396 | ^ Warning: ‘t586’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:283:31: 283 | t575, t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, & | ^ note: ‘t586’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 | ^ Warning: ‘t580’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:283:25: 283 | t575, t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, & | ^ note: ‘t580’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: 775 | *t36*t38*t1396 | ^ Warning: ‘t576’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:283:19: 283 | t575, t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, & | ^ note: ‘t576’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t575’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:283:13: 283 | t575, t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, & | ^ note: ‘t575’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: 775 | *t36*t38*t1396 | ^ Warning: ‘t574’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:96: 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & | ^ note: ‘t574’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 | ^ Warning: ‘t573’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:90: 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & | ^ note: ‘t573’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t572’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:84: 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & | ^ note: ‘t572’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t571’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:78: 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & | ^ note: ‘t571’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t570’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:72: 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & | ^ note: ‘t570’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: 775 | *t36*t38*t1396 | ^ Warning: ‘t566’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:66: 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & | ^ note: ‘t566’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: 775 | *t36*t38*t1396 | ^ Warning: ‘t562’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:60: 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & | ^ note: ‘t562’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:400:26: 400 | t151 | ^ Warning: ‘t55’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:54: 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & | ^ note: ‘t55’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t539’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:49: 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & | ^ note: ‘t539’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t537’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:43: 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & | ^ note: ‘t537’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t536’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:37: 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & | ^ note: ‘t536’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: 784 | t98*t1400 | ^ Warning: ‘t530’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:19: 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & | ^ note: ‘t530’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:817:44: 817 | *sx | ^ Warning: ‘t529’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:13: 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & | ^ note: ‘t529’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) | ^ Warning: ‘t526’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:93: 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & | ^ note: ‘t526’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) | ^ Warning: ‘t525’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:87: 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & | ^ note: ‘t525’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) | ^ Warning: ‘t521’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:81: 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & | ^ note: ‘t521’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:415:59: 415 | *t52 - 0.5000000001e0_dp*t41*t172*t46 | ^ Warning: ‘t52’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:75: 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & | ^ note: ‘t52’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:598:38: 598 | t624 = 0.1e1_dp/t8/t519 | ^ Warning: ‘t519’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:70: 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & | ^ note: ‘t519’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) | ^ Warning: ‘t514’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:64: 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & | ^ note: ‘t514’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) | ^ Warning: ‘t513’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:58: 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & | ^ note: ‘t513’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:475:33: 475 | t339 = t48*t10*t51 | ^ Warning: ‘t51’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:52: 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & | ^ note: ‘t51’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) | ^ Warning: ‘t508’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:47: 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & | ^ note: ‘t508’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: 784 | t98*t1400 | ^ Warning: ‘t505’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:41: 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & | ^ note: ‘t505’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: 784 | t98*t1400 | ^ Warning: ‘t502’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:35: 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & | ^ note: ‘t502’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:817:44: 817 | *sx | ^ Warning: ‘t501’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:29: 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & | ^ note: ‘t501’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:613:63: 613 | /t69*t669) | ^ Warning: ‘t5’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:23: 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & | ^ note: ‘t5’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:662:30: 662 | t857 = t27*t496 | ^ Warning: ‘t496’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:19: 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & | ^ note: ‘t496’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:716:76: 716 | + t1136) | ^ Warning: ‘t492’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:13: 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & | ^ note: ‘t492’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: 687 | - 0.1111111111e0_dp*t117*t293*t404 | ^ Warning: ‘t49’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:96: 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & | ^ note: ‘t49’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 | ^ Warning: ‘t489’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:91: 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & | ^ note: ‘t489’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 | ^ Warning: ‘t486’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:85: 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & | ^ note: ‘t486’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 | ^ Warning: ‘t482’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:79: 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & | ^ note: ‘t482’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 | ^ Warning: ‘t479’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:68: 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & | ^ note: ‘t479’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:701:68: 701 | *t335*t486 - 0.1000000001e1_dp*t94*t135*t1091 | ^ Warning: ‘t478’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:62: 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & | ^ note: ‘t478’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 | ^ Warning: ‘t473’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:56: 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & | ^ note: ‘t473’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:701:68: 701 | *t335*t486 - 0.1000000001e1_dp*t94*t135*t1091 | ^ Warning: ‘t470’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:50: 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & | ^ note: ‘t470’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:637:40: 637 | REAL(t46, KIND=dp) | ^ Warning: ‘t47’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:44: 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & | ^ note: ‘t47’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 | ^ Warning: ‘t467’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:39: 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & | ^ note: ‘t467’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t466’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:33: 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & | ^ note: ‘t466’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 | ^ Warning: ‘t465’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:27: 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & | ^ note: ‘t465’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 | ^ Warning: ‘t464’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:71: 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 | ^ note: ‘t464’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: 708 | t41*t328*t466 | ^ Warning: ‘t463’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:65: 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 | ^ note: ‘t463’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: 708 | t41*t328*t466 | ^ Warning: ‘t462’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:59: 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 | ^ note: ‘t462’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: 687 | - 0.1111111111e0_dp*t117*t293*t404 | ^ Warning: ‘t460’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:53: 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 | ^ note: ‘t460’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:415:59: 415 | *t52 - 0.5000000001e0_dp*t41*t172*t46 | ^ Warning: ‘t46’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:47: 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 | ^ note: ‘t46’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: 687 | - 0.1111111111e0_dp*t117*t293*t404 | ^ Warning: ‘t457’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:42: 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 | ^ note: ‘t457’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: 687 | - 0.1111111111e0_dp*t117*t293*t404 | ^ Warning: ‘t455’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:36: 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 | ^ note: ‘t455’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:745:57: 745 | + 0.5999999999e1_dp*t128*t132*t529 | ^ Warning: ‘t452’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:30: 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 | ^ note: ‘t452’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t451’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:24: 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 | ^ note: ‘t451’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:370:49: 370 | t103 = EXP(-0.9000000000e1_dp*t44) | ^ Warning: ‘t44’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:18: 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 | ^ note: ‘t44’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: 775 | *t36*t38*t1396 | ^ Warning: ‘t435’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:13: 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 | ^ note: ‘t435’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:384:34: 384 | t130 = t128*t43*t94 | ^ Warning: ‘t43’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:93: 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & | ^ note: ‘t43’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: 775 | *t36*t38*t1396 | ^ Warning: ‘t429’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:88: 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & | ^ note: ‘t429’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: 687 | - 0.1111111111e0_dp*t117*t293*t404 | ^ Warning: ‘t428’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:82: 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & | ^ note: ‘t428’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:386:30: 386 | t133 = t42*t132 | ^ Warning: ‘t42’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:76: 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & | ^ note: ‘t42’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: 775 | *t36*t38*t1396 | ^ Warning: ‘t418’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:71: 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & | ^ note: ‘t418’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: 687 | - 0.1111111111e0_dp*t117*t293*t404 | ^ Warning: ‘t417’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:65: 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & | ^ note: ‘t417’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: 775 | *t36*t38*t1396 | ^ Warning: ‘t413’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:59: 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & | ^ note: ‘t413’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:535:30: 535 | t489 = t41*t135 | ^ Warning: ‘t41’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:47: 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & | ^ note: ‘t41’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:725:76: 725 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) | ^ Warning: ‘t408’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:42: 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & | ^ note: ‘t408’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:725:76: 725 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) | ^ Warning: ‘t405’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:36: 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & | ^ note: ‘t405’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: 784 | t98*t1400 | ^ Warning: ‘t404’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:30: 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & | ^ note: ‘t404’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) | ^ Warning: ‘t401’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:24: 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & | ^ note: ‘t401’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) | ^ Warning: ‘t400’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:18: 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & | ^ note: ‘t400’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:383:30: 383 | t128 = t40*t127 | ^ Warning: ‘t40’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:12: 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & | ^ note: ‘t40’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) | ^ Warning: ‘t397’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:93: 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & | ^ note: ‘t397’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) | ^ Warning: ‘t393’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:87: 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & | ^ note: ‘t393’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:389:29: 389 | t137 = t39*t94 | ^ Warning: ‘t39’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:81: 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & | ^ note: ‘t39’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) | ^ Warning: ‘t384’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:76: 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & | ^ note: ‘t384’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) | ^ Warning: ‘t383’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:70: 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & | ^ note: ‘t383’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: 673 | *t244*my_ndrho/t657/t7*t669) | ^ Warning: ‘t382’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:64: 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & | ^ note: ‘t382’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:488:68: 488 | t36*t122*t151 + 0.3333333334e0_dp*t36*t38*t354 | ^ Warning: ‘t38’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:58: 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & | ^ note: ‘t38’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) | ^ Warning: ‘t377’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:53: 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & | ^ note: ‘t377’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:725:76: 725 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) | ^ Warning: ‘t372’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:47: 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & | ^ note: ‘t372’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:517:30: 517 | t435 = t37*t196 | ^ Warning: ‘t37’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:41: 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & | ^ note: ‘t37’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: 784 | t98*t1400 | ^ Warning: ‘t368’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:36: 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & | ^ note: ‘t368’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: 784 | t98*t1400 | ^ Warning: ‘t365’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:30: 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & | ^ note: ‘t365’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: 784 | t98*t1400 | ^ Warning: ‘t36’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:24: 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & | ^ note: ‘t36’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:594:30: 594 | t601 = t27*t358 | ^ Warning: ‘t358’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:19: 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & | ^ note: ‘t358’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:652:54: 652 | + 0.3333333334e0_dp*t36*t38*t838 | ^ Warning: ‘t354’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:13: 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & | ^ note: ‘t354’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: 708 | t41*t328*t466 | ^ Warning: ‘t351’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:96: 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & | ^ note: ‘t351’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: 708 | t41*t328*t466 | ^ Warning: ‘t347’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:90: 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & | ^ note: ‘t347’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:637:40: 637 | REAL(t46, KIND=dp) | ^ Warning: ‘t346’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:84: 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & | ^ note: ‘t346’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: 708 | t41*t328*t466 | ^ Warning: ‘t343’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:78: 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & | ^ note: ‘t343’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: 708 | t41*t328*t466 | ^ Warning: ‘t339’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:67: 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & | ^ note: ‘t339’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:701:68: 701 | *t335*t486 - 0.1000000001e1_dp*t94*t135*t1091 | ^ Warning: ‘t335’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:61: 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & | ^ note: ‘t335’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:637:40: 637 | REAL(t46, KIND=dp) | ^ Warning: ‘t330’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:55: 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & | ^ note: ‘t330’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: 708 | t41*t328*t466 | ^ Warning: ‘t328’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:49: 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & | ^ note: ‘t328’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: 708 | t41*t328*t466 | ^ Warning: ‘t326’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:43: 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & | ^ note: ‘t326’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:652:54: 652 | + 0.3333333334e0_dp*t36*t38*t838 | ^ Warning: ‘t325’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:37: 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & | ^ note: ‘t325’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:694:38: 694 | *t128*t323*t172 | ^ Warning: ‘t323’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:31: 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & | ^ note: ‘t323’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:652:54: 652 | + 0.3333333334e0_dp*t36*t38*t838 | ^ Warning: ‘t321’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:25: 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & | ^ note: ‘t321’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:652:54: 652 | + 0.3333333334e0_dp*t36*t38*t838 | ^ Warning: ‘t319’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:19: 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & | ^ note: ‘t319’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:652:54: 652 | + 0.3333333334e0_dp*t36*t38*t838 | ^ Warning: ‘t316’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:13: 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & | ^ note: ‘t316’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: 775 | *t36*t38*t1396 | ^ Warning: ‘t313’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:97: 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & | ^ note: ‘t313’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 | ^ Warning: ‘t312’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:91: 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & | ^ note: ‘t312’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:457:31: 457 | *t30*t281 | ^ Warning: ‘t31’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:79: 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & | ^ note: ‘t31’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:716:76: 716 | + t1136) | ^ Warning: ‘t304’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:74: 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & | ^ note: ‘t304’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:375:26: 375 | t109 | ^ Warning: ‘t30’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:68: 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & | ^ note: ‘t30’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:460:28: 460 | t293 = t3*t55 | ^ Warning: ‘t3’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:63: 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & | ^ note: ‘t3’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: 775 | *t36*t38*t1396 | ^ Warning: ‘t297’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:59: 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & | ^ note: ‘t297’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: 775 | *t36*t38*t1396 | ^ Warning: ‘t293’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:53: 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & | ^ note: ‘t293’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:425:38: 425 | t211 = my_rho*t29*omega | ^ Warning: ‘t29’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:47: 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & | ^ note: ‘t29’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: 775 | *t36*t38*t1396 | ^ Warning: ‘t289’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:42: 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & | ^ note: ‘t289’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: 687 | - 0.1111111111e0_dp*t117*t293*t404 | ^ Warning: ‘t285’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:36: 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & | ^ note: ‘t285’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:652:54: 652 | + 0.3333333334e0_dp*t36*t38*t838 | ^ Warning: ‘t284’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:30: 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & | ^ note: ‘t284’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: 687 | - 0.1111111111e0_dp*t117*t293*t404 | ^ Warning: ‘t281’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:24: 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & | ^ note: ‘t281’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:372:30: 372 | t105 = t28*t104 | ^ Warning: ‘t28’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:18: 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & | ^ note: ‘t28’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: 775 | *t36*t38*t1396 | ^ Warning: ‘t271’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:13: 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & | ^ note: ‘t271’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t270’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:94: 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & | ^ note: ‘t270’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: 687 | - 0.1111111111e0_dp*t117*t293*t404 | ^ Warning: ‘t265’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:83: 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & | ^ note: ‘t265’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: 687 | - 0.1111111111e0_dp*t117*t293*t404 | ^ Warning: ‘t264’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:77: 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & | ^ note: ‘t264’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:658:67: 658 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 | ^ Warning: ‘t259’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:66: 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & | ^ note: ‘t259’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:725:76: 725 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) | ^ Warning: ‘t258’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:60: 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & | ^ note: ‘t258’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: 673 | *t244*my_ndrho/t657/t7*t669) | ^ Warning: ‘t255’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:54: 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & | ^ note: ‘t255’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: 673 | *t244*my_ndrho/t657/t7*t669) | ^ Warning: ‘t254’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:48: 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & | ^ note: ‘t254’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: 673 | *t244*my_ndrho/t657/t7*t669) | ^ Warning: ‘t251’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:42: 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & | ^ note: ‘t251’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) | ^ Warning: ‘t250’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:36: 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & | ^ note: ‘t250’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) | ^ Warning: ‘t245’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:30: 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & | ^ note: ‘t245’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: 673 | *t244*my_ndrho/t657/t7*t669) | ^ Warning: ‘t244’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:24: 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & | ^ note: ‘t244’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: 673 | *t244*my_ndrho/t657/t7*t669) | ^ Warning: ‘t241’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:18: 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & | ^ note: ‘t241’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:658:67: 658 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 | ^ Warning: ‘t24’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:12: 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & | ^ note: ‘t24’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: 673 | *t244*my_ndrho/t657/t7*t669) | ^ Warning: ‘t237’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:97: 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & | ^ note: ‘t237’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: 673 | *t244*my_ndrho/t657/t7*t669) | ^ Warning: ‘t233’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:91: 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & | ^ note: ‘t233’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: 673 | *t244*my_ndrho/t657/t7*t669) | ^ Warning: ‘t232’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:85: 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & | ^ note: ‘t232’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) | ^ Warning: ‘t230’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:73: 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & | ^ note: ‘t230’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:371:34: 371 | t104 = 0.1e1_dp/t23 | ^ Warning: ‘t23’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:67: 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & | ^ note: ‘t23’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: 673 | *t244*my_ndrho/t657/t7*t669) | ^ Warning: ‘t226’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:62: 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & | ^ note: ‘t226’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) | ^ Warning: ‘t225’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:56: 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & | ^ note: ‘t225’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: 673 | *t244*my_ndrho/t657/t7*t669) | ^ Warning: ‘t222’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:50: 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & | ^ note: ‘t222’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:599:30: 599 | t628 = t221*t76 | ^ Warning: ‘t221’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:44: 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & | ^ note: ‘t221’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:350:37: 350 | t68 = my_rho*t22*omega | ^ Warning: ‘t22’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:38: 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & | ^ note: ‘t22’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:613:63: 613 | /t69*t669) | ^ Warning: ‘t219’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:33: 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & | ^ note: ‘t219’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:658:67: 658 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 | ^ Warning: ‘t216’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:27: 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & | ^ note: ‘t216’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:658:67: 658 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 | ^ Warning: ‘t213’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:70: 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 | ^ note: ‘t213’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:725:76: 725 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) | ^ Warning: ‘t212’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:64: 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 | ^ note: ‘t212’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:725:76: 725 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) | ^ Warning: ‘t211’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:58: 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 | ^ note: ‘t211’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:463:30: 463 | t311 = t126*t21 | ^ Warning: ‘t21’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:52: 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 | ^ note: ‘t21’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: 784 | t98*t1400 | ^ Warning: ‘t207’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:47: 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 | ^ note: ‘t207’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:494:30: 494 | t365 = t27*t200 | ^ Warning: ‘t200’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:41: 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 | ^ note: ‘t200’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:577:29: 577 | t576 = t2*t501 | ^ Warning: ‘t2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:35: 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 | ^ note: ‘t2’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:544:70: 544 | *t117*t297*t172 + 0.3333333334e0_dp*t36*t38*t492 | ^ Warning: ‘t196’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:31: 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 | ^ note: ‘t196’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: 708 | t41*t328*t466 | ^ Warning: ‘t190’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:25: 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 | ^ note: ‘t190’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t186’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:19: 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 | ^ note: ‘t186’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t185’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:13: 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 | ^ note: ‘t185’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:407:59: 407 | t172 = 0.40e1_dp*t11*t18 - 0.20e1_dp*t6*t169 | ^ Warning: ‘t18’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:96: 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & | ^ note: ‘t18’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t177’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:91: 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & | ^ note: ‘t177’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:549:69: 549 | *t24*t98*t496)*sx | ^ Warning: ‘t173’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:79: 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & | ^ note: ‘t173’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:586:35: 586 | *t36*t38*t586 | ^ Warning: ‘t172’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:73: 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & | ^ note: ‘t172’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:353:28: 353 | t72 = t71*t17 | ^ Warning: ‘t17’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:67: 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & | ^ note: ‘t17’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:562:41: 562 | - 0.20e1_dp*t6*t526 | ^ Warning: ‘t169’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:62: 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & | ^ note: ‘t169’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:497:31: 497 | t377 = t225*t168 | ^ Warning: ‘t168’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:56: 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & | ^ note: ‘t168’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:434:38: 434 | t230 = 0.1e1_dp/t75/t16 | ^ Warning: ‘t16’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:50: 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & | ^ note: ‘t16’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:424:30: 424 | t207 = t27*t155 | ^ Warning: ‘t155’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:38: 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & | ^ note: ‘t155’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:488:68: 488 | t36*t122*t151 + 0.3333333334e0_dp*t36*t38*t354 | ^ Warning: ‘t151’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:32: 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & | ^ note: ‘t151’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:539:82: 539 | - 0.5555555558e-1_dp*t146*t486 - 0.5000000001e0_dp*t489*t466 | ^ Warning: ‘t148’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:26: 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & | ^ note: ‘t148’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: 708 | t41*t328*t466 | ^ Warning: ‘t147’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:13: 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & | ^ note: ‘t147’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: 708 | t41*t328*t466 | ^ Warning: ‘t146’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:270:87: 270 | t1370, t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, & | ^ note: ‘t146’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:539:82: 539 | - 0.5555555558e-1_dp*t146*t486 - 0.5000000001e0_dp*t489*t466 | ^ Warning: ‘t143’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:270:67: 270 | t1370, t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, & | ^ note: ‘t143’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:476:35: 476 | t343 = t141*t135*t46 | ^ Warning: ‘t141’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:270:54: 270 | t1370, t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, & | ^ note: ‘t141’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ Warning: ‘t140’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:270:27: 270 | t1370, t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, & | ^ note: ‘t140’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:637:40: 637 | REAL(t46, KIND=dp) | ^ Warning: ‘t137’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:96: 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & | ^ note: ‘t137’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:701:68: 701 | *t335*t486 - 0.1000000001e1_dp*t94*t135*t1091 | ^ Warning: ‘t136’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:90: 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & | ^ note: ‘t136’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:535:30: 535 | t489 = t41*t135 | ^ Warning: ‘t135’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:84: 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & | ^ note: ‘t135’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:450:69: 450 | t264 = 0.9000000000e1_dp*t130 - 0.6000000000e1_dp*t133 | ^ Warning: ‘t133’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:57: 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & | ^ note: ‘t133’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:745:57: 745 | + 0.5999999999e1_dp*t128*t132*t529 | ^ Warning: ‘t132’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:51: 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & | ^ note: ‘t132’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:450:69: 450 | t264 = 0.9000000000e1_dp*t130 - 0.6000000000e1_dp*t133 | ^ Warning: ‘t130’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:45: 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & | ^ note: ‘t130’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:468:35: 468 | t321 = t128*t43*t258 | ^ Warning: ‘t128’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:32: 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & | ^ note: ‘t128’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:530:30: 530 | t473 = t94*t127 | ^ Warning: ‘t127’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:26: 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & | ^ note: ‘t127’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:463:30: 463 | t311 = t126*t21 | ^ Warning: ‘t126’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:20: 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & | ^ note: ‘t126’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:544:70: 544 | *t117*t297*t172 + 0.3333333334e0_dp*t36*t38*t492 | ^ Warning: ‘t122’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:268:92: 268 | t1136, t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, & | ^ note: ‘t122’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:405:67: 405 | t168 = 0.60e1_dp*beta*t3*t12 + 0.60e1_dp*t11*t10*t86 | ^ Warning: ‘t12’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:268:86: 268 | t1136, t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, & | ^ note: ‘t12’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:488:68: 488 | t36*t122*t151 + 0.3333333334e0_dp*t36*t38*t354 | ^ Warning: ‘t118’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:268:81: 268 | t1136, t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, & | ^ note: ‘t118’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: 775 | *t36*t38*t1396 | ^ Warning: ‘t117’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:268:68: 268 | t1136, t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, & | ^ note: ‘t117’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: 784 | t98*t1400 | ^ Warning: ‘t116’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:268:48: 268 | t1136, t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, & | ^ note: ‘t116’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: 775 | *t36*t38*t1396 | ^ Warning: ‘t113’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:267:96: 267 | t1009, t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, & | ^ note: ‘t113’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: 687 | - 0.1111111111e0_dp*t117*t293*t404 | ^ Warning: ‘t112’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:267:90: 267 | t1009, t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, & | ^ note: ‘t112’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) | ^ Warning: ‘t11’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:267:77: 267 | t1009, t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, & | ^ note: ‘t11’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:515:66: 515 | *t31*t404 - 0.5000000000e0_dp*t105*t109*t172 | ^ Warning: ‘t109’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:267:65: 267 | t1009, t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, & | ^ note: ‘t109’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:586:35: 586 | *t36*t38*t586 | ^ Warning: ‘t105’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:267:52: 267 | t1009, t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, & | ^ note: ‘t105’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:595:39: 595 | t605 = my_rho*t104*omega | ^ Warning: ‘t104’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:267:39: 267 | t1009, t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, & | ^ note: ‘t104’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:586:35: 586 | *t36*t38*t586 | ^ Warning: ‘t103’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:267:33: 267 | t1009, t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, & | ^ note: ‘t103’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:405:67: 405 | t168 = 0.60e1_dp*beta*t3*t12 + 0.60e1_dp*t11*t10*t86 | ^ Warning: ‘t10’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:266:83: 266 | REAL(kind=dp) :: Cx, epsilon_rho43, my_epsilon_rho, my_ndrho, my_rho, t1, t10, t100, t1002, & | ^ note: ‘t10’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:417:69: 417 | t117*t118*t172 + 0.3333333334e0_dp*t36*t38*t196 | ^ Warning: ‘t1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:266:78: 266 | REAL(kind=dp) :: Cx, epsilon_rho43, my_epsilon_rho, my_ndrho, my_rho, t1, t10, t100, t1002, & | ^ note: ‘t1’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_xbecke88_long_range.mod' due to: xc_xbecke88_long_range.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_long_range.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_array_utils.mod mathconstants.mod bibliography.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_sr_lda.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_sr_lda.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod input_section_types.mod xc_rho_set_types.mod base_hooks.mod xc_functionals_utilities.mod kinds.mod mathconstants.mod bibliography.mod xc_input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_sr_lda.F xc_sr_lda.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:58:14 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_sr_lda.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_sr_lda.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_sr_lda.mod' due to: xc_sr_lda.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_sr_lda.F /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_perdew_wang.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod input_section_types.mod xc_rho_set_types.mod base_hooks.mod xc_functionals_utilities.mod kinds.mod mathconstants.mod bibliography.mod xc_input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_lyp.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod mathconstants.mod bibliography.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp.F xc_lyp.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:58:16 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_lyp.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_lyp.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_lyp.mod' due to: xc_lyp.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod mathconstants.mod bibliography.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_ke_gga.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_ke_gga.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod base_hooks.mod xc_functionals_utilities.mod kinds.mod cp_array_utils.mod mathconstants.mod xc_input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_ke_gga.F xc_ke_gga.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:58:18 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_ke_gga.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_ke_gga.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_ke_gga.mod' due to: xc_ke_gga.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_ke_gga.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod base_hooks.mod xc_functionals_utilities.mod kinds.mod cp_array_utils.mod mathconstants.mod xc_input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_xbecke88.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_array_utils.mod mathconstants.mod bibliography.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88.F xc_xbecke88.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:58:22 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xbecke88.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xbecke88.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_xbecke88.mod' due to: xc_xbecke88.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_array_utils.mod mathconstants.mod bibliography.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_b97.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_b97.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod input_section_types.mod xc_rho_set_types.mod base_hooks.mod kinds.mod mathconstants.mod bibliography.mod xc_input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_b97.F xc_b97.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:58:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_b97.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_b97.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_b97.mod' due to: xc_b97.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_b97.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod input_section_types.mod xc_rho_set_types.mod base_hooks.mod kinds.mod mathconstants.mod bibliography.mod xc_input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_hcth.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_hcth.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathconstants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_hcth.F xc_hcth.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:58:31 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_hcth.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_hcth.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_hcth.mod' due to: xc_hcth.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_hcth.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathconstants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_lyp_adiabatic.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod mathconstants.mod bibliography.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F xc_lyp_adiabatic.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:58:32 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_lyp_adiabatic.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_lyp_adiabatic.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:656:132: 656 | + t18*t90*t421*d - REAL(2*t95*t96*my_rhob*t108*my_ndrho, dp)) | ^ Warning: ‘t96’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:91: 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 | ^ note: ‘t96’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:656:132: 656 | + t18*t90*t421*d - REAL(2*t95*t96*my_rhob*t108*my_ndrho, dp)) | ^ Warning: ‘t95’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:86: 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 | ^ note: ‘t95’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:643:132: 643 | my_ndrhoa, dp) - 0.2222222222e0_dp*t115*my_rhoa*t355)) | ^ Warning: ‘t94’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:81: 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 | ^ note: ‘t94’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:600:40: 600 | t250 = 4*t18*t78*t141*t91 | ^ Warning: ‘t91’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:76: 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 | ^ note: ‘t91’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:619:103: 619 | t300 - 0.1111111111e0_dp*t115*t188) | ^ Warning: ‘t90’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:71: 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 | ^ note: ‘t90’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:592:37: 592 | t216 = 0.1e1_dp/t77/t9 | ^ Warning: ‘t9’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:66: 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 | ^ note: ‘t9’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:597:59: 597 | t231 = t14*t223*t225*lambda*t17*t87/0.3e1_dp | ^ Warning: ‘t87’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:62: 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 | ^ note: ‘t87’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:619:103: 619 | t300 - 0.1111111111e0_dp*t115*t188) | ^ Warning: ‘t86’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:57: 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 | ^ note: ‘t86’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:569:38: 569 | t153 = 0.1e1_dp/t21/t84 | ^ Warning: ‘t84’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:47: 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 | ^ note: ‘t84’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:631:108: 631 | - t300 - 0.1111111111e0_dp*t115*t316) | ^ Warning: ‘t80’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:37: 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 | ^ note: ‘t80’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:606:42: 606 | t280 = t102*t169*t78*lambda | ^ Warning: ‘t78’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:32: 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 | ^ note: ‘t78’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:592:37: 592 | t216 = 0.1e1_dp/t77/t9 | ^ Warning: ‘t77’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:27: 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 | ^ note: ‘t77’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:605:31: 605 | t276 = d*t76*t10 | ^ Warning: ‘t76’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:22: 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 | ^ note: ‘t76’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:593:71: 593 | t220 = 0.26666666666666666667e1_dp*t74/t21/t19*t216*t103 | ^ Warning: ‘t74’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:17: 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 | ^ note: ‘t74’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:656:132: 656 | + t18*t90*t421*d - REAL(2*t95*t96*my_rhob*t108*my_ndrho, dp)) | ^ Warning: ‘t73’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:12: 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 | ^ note: ‘t73’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:599:66: 599 | t246 = 0.2e1_dp/0.3e1_dp*t14*t17*t216*t225*t67*t103 | ^ Warning: ‘t67’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:90: 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & | ^ note: ‘t67’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:639:61: 639 | *t355) + REAL(2*t65*my_ndrhoa, dp) | ^ Warning: ‘t65’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:85: 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & | ^ note: ‘t65’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:647:61: 647 | *t387) + REAL(2*t63*my_ndrhob, dp) | ^ Warning: ‘t63’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:80: 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & | ^ note: ‘t63’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:561:41: 561 | t135 = 0.1e1_dp/t6/t19*t78 | ^ Warning: ‘t6’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:70: 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & | ^ note: ‘t6’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:627:67: 627 | *t48 + (t199 - 0.6666666667e0_dp*my_rhob)*t47 | ^ Warning: ‘t58’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:66: 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & | ^ note: ‘t58’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:615:60: 615 | /0.3e1_dp*t285)*t55 | ^ Warning: ‘t55’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:61: 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & | ^ note: ‘t55’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:639:61: 639 | *t355) + REAL(2*t65*my_ndrhoa, dp) | ^ Warning: ‘t51’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:56: 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & | ^ note: ‘t51’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:568:51: 568 | t151 = t14*t146*t141*t67*t5/0.3e1_dp | ^ Warning: ‘t5’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:51: 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & | ^ note: ‘t5’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:613:26: 613 | *t49 | ^ Warning: ‘t49’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:47: 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & | ^ note: ‘t49’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:590:132: 590 | *my_rhoa + t196)*t48 + t200*t47 | ^ Warning: ‘t48’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:42: 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & | ^ note: ‘t48’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:627:67: 627 | *t48 + (t199 - 0.6666666667e0_dp*my_rhob)*t47 | ^ Warning: ‘t47’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:37: 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & | ^ note: ‘t47’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:639:61: 639 | *t355) + REAL(2*t65*my_ndrhoa, dp) | ^ Warning: ‘t46’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:32: 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & | ^ note: ‘t46’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:610:26: 610 | *t42 | ^ Warning: ‘t42’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:463:73: 463 | t32, t325, t348, t351, t355, t362, t387, t39, t394, t4, t41, t42 | ^ note: ‘t42’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:653:103: 653 | t421 = REAL(2*t25*t41*my_ndrho, dp) - 0.1333333333e1_dp*REAL(t19, dp)*REAL(my_ndrho, dp) | ^ Warning: ‘t41’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:463:68: 463 | t32, t325, t348, t351, t355, t362, t387, t39, t394, t4, t41, t42 | ^ note: ‘t41’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:627:67: 627 | *t48 + (t199 - 0.6666666667e0_dp*my_rhob)*t47 | ^ Warning: ‘t32’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:463:12: 463 | t32, t325, t348, t351, t355, t362, t387, t39, t394, t4, t41, t42 | ^ note: ‘t32’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:645:34: 645 | t387 = t3*my_ndrhob | ^ Warning: ‘t3’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:462:69: 462 | t266, t27, t270, t273, t276, t28, t280, t285, t288, t294, t3, t30, t300, t307, t31, t316, & | ^ note: ‘t3’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:590:132: 590 | *my_rhoa + t196)*t48 + t200*t47 | ^ Warning: ‘t28’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:462:41: 462 | t266, t27, t270, t273, t276, t28, t280, t285, t288, t294, t3, t30, t300, t307, t31, t316, & | ^ note: ‘t28’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:647:61: 647 | *t387) + REAL(2*t63*my_ndrhob, dp) | ^ Warning: ‘t25’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:461:76: 461 | t212, t216, t220, t222, t223, t225, t23, t231, t237, t24, t246, t25, t250, t259, t26, & | ^ note: ‘t25’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:619:103: 619 | t300 - 0.1111111111e0_dp*t115*t188) | ^ Warning: ‘t24’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:461:65: 461 | t212, t216, t220, t222, t223, t225, t23, t231, t237, t24, t246, t25, t250, t259, t26, & | ^ note: ‘t24’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:643:132: 643 | my_ndrhoa, dp) - 0.2222222222e0_dp*t115*my_rhoa*t355)) | ^ Warning: ‘t23’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:461:48: 461 | t212, t216, t220, t222, t223, t225, t23, t231, t237, t24, t246, t25, t250, t259, t26, & | ^ note: ‘t23’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:593:71: 593 | t220 = 0.26666666666666666667e1_dp*t74/t21/t19*t216*t103 | ^ Warning: ‘t21’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:460:92: 460 | t174, t179, t18, t183, t186, t187, t188, t19, t194, t196, t199, t2, t200, t202, t21, & | ^ note: ‘t21’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:584:46: 584 | t194 = 0.1333333333e1_dp*t2*t42 | ^ Warning: ‘t2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:460:75: 460 | t174, t179, t18, t183, t186, t187, t188, t19, t194, t196, t199, t2, t200, t202, t21, & | ^ note: ‘t2’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:653:103: 653 | t421 = REAL(2*t25*t41*my_ndrho, dp) - 0.1333333333e1_dp*REAL(t19, dp)*REAL(my_ndrho, dp) | ^ Warning: ‘t19’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:460:53: 460 | t174, t179, t18, t183, t186, t187, t188, t19, t194, t196, t199, t2, t200, t202, t21, & | ^ note: ‘t19’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:619:103: 619 | t300 - 0.1111111111e0_dp*t115*t188) | ^ Warning: ‘t18’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:460:24: 460 | t174, t179, t18, t183, t186, t187, t188, t19, t194, t196, t199, t2, t200, t202, t21, & | ^ note: ‘t18’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:597:59: 597 | t231 = t14*t223*t225*lambda*t17*t87/0.3e1_dp | ^ Warning: ‘t17’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:459:88: 459 | t140, t141, t143, t145, t146, t15, t151, t153, t157, t16, t162, t165, t169, t17, t171, & | ^ note: ‘t17’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:571:29: 571 | t162 = t15*t76 | ^ Warning: ‘t15’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:459:42: 459 | t140, t141, t143, t145, t146, t15, t151, t153, t157, t16, t162, t165, t169, t17, t171, & | ^ note: ‘t15’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:619:103: 619 | t300 - 0.1111111111e0_dp*t115*t188) | ^ Warning: ‘t119’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:458:49: 458 | t103, t106, t108, t113, t115, t118, t119, t124, t125, t128, t129, t132, t135, t138, t14, & | ^ note: ‘t119’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:631:108: 631 | - t300 - 0.1111111111e0_dp*t115*t316) | ^ Warning: ‘t118’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:458:43: 458 | t103, t106, t108, t113, t115, t118, t119, t124, t125, t128, t129, t132, t135, t138, t14, & | ^ note: ‘t118’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:643:132: 643 | my_ndrhoa, dp) - 0.2222222222e0_dp*t115*my_rhoa*t355)) | ^ Warning: ‘t115’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:458:37: 458 | t103, t106, t108, t113, t115, t118, t119, t124, t125, t128, t129, t132, t135, t138, t14, & | ^ note: ‘t115’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:643:132: 643 | my_ndrhoa, dp) - 0.2222222222e0_dp*t115*my_rhoa*t355)) | ^ Warning: ‘t113’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:458:31: 458 | t103, t106, t108, t113, t115, t118, t119, t124, t125, t128, t129, t132, t135, t138, t14, & | ^ note: ‘t113’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:656:132: 656 | + t18*t90*t421*d - REAL(2*t95*t96*my_rhob*t108*my_ndrho, dp)) | ^ Warning: ‘t108’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:458:25: 458 | t103, t106, t108, t113, t115, t118, t119, t124, t125, t128, t129, t132, t135, t138, t14, & | ^ note: ‘t108’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:599:66: 599 | t246 = 0.2e1_dp/0.3e1_dp*t14*t17*t216*t225*t67*t103 | ^ Warning: ‘t103’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:458:13: 458 | t103, t106, t108, t113, t115, t118, t119, t124, t125, t128, t129, t132, t135, t138, t14, & | ^ note: ‘t103’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:619:103: 619 | t300 - 0.1111111111e0_dp*t115*t188) | ^ Warning: ‘t10’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:457:84: 457 | REAL(KIND=dp) :: cf, my_ndrho, my_ndrhoa, my_ndrhob, my_rhoa, my_rhob, t1, t10, t100, t102, & | ^ note: ‘t10’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:560:43: 560 | t132 = 0.40e1_dp*t1*t129*t10 | ^ Warning: ‘t1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:457:79: 457 | REAL(KIND=dp) :: cf, my_ndrho, my_ndrhoa, my_ndrhob, my_rhoa, my_rhob, t1, t10, t100, t102, & | ^ note: ‘t1’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_lyp_adiabatic.mod' due to: xc_lyp_adiabatic.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_lyp_adiabatic.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod mathconstants.mod bibliography.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_xlda_hole_t_c_lr.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod mathlib.mod mathconstants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F xc_xlda_hole_t_c_lr.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:58:33 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xlda_hole_t_c_lr.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xlda_hole_t_c_lr.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: 291 | /0.3e1_dp - C*t15*t3*t6*t4*t25))*sx | ^ Warning: ‘t9’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: ‘t7’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: ‘t68’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: ‘t67’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: ‘t6’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: ‘t5’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: ‘t32’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: ‘t25’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: ‘t2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: ‘t15’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: ‘t14’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: ‘t1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_xlda_hole_t_c_lr.mod' due to: xc_xlda_hole_t_c_lr.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod mathlib.mod mathconstants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_xbeef.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbeef.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_array_utils.mod mathconstants.mod bibliography.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbeef.F xc_xbeef.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:58:34 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xbeef.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xbeef.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbeef.F:489:109: 489 | e_rho_spin(ii) = e_rho_spin(ii) + (SUM(e_leg*a)*e_ueg_drho + SUM(de_leg*a)*dt*ds_rho*e_ueg)*sx | ^ Warning: ‘dt’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbeef.F:489:109: Warning: ‘ds_rho’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbeef.F:490:89: 490 | e_ndrho_spin(ii) = e_ndrho_spin(ii) + (SUM(de_leg*a)*dt*ds_ndrho*e_ueg)*sx | ^ Warning: ‘ds_ndrho’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbeef.F:287:99: 287 | e_rho(ii) = e_rho(ii) + (SUM(e_leg*a)*e_ueg_drho + SUM(de_leg*a)*dt*ds_rho*e_ueg)*sx | ^ Warning: ‘dt’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbeef.F:287:99: Warning: ‘ds_rho’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbeef.F:288:79: 288 | e_ndrho(ii) = e_ndrho(ii) + (SUM(de_leg*a)*dt*ds_ndrho*e_ueg)*sx | ^ Warning: ‘ds_ndrho’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_xbeef.mod' due to: xc_xbeef.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbeef.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_array_utils.mod mathconstants.mod bibliography.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_xbecke_roussel.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod mathconstants.mod bibliography.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F xc_xbecke_roussel.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:58:36 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xbecke_roussel.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xbecke_roussel.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2472:31: 2472 | t305 = t99*t271*R*t302 | ^ Warning: ‘t99’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2304:36: 2304 | t9, t91, t94, t97, t98, t99 | ^ note: ‘t99’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2578:28: 2578 | t614 = t43*t612*t98 | ^ Warning: ‘t98’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2304:31: 2304 | t9, t91, t94, t97, t98, t99 | ^ note: ‘t98’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2572:34: 2572 | + t36*t37/0.4e1_dp | ^ Warning: ‘t9’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2304:11: 2304 | t9, t91, t94, t97, t98, t99 | ^ note: ‘t9’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2477:24: 2477 | t318 = t123*t81 | ^ Warning: ‘t81’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2303:81: 2303 | REAL(KIND=dp) :: t679, t682, t7, t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, & | ^ note: ‘t81’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2479:28: 2479 | t330 = t179*t80*t98 | ^ Warning: ‘t80’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2303:76: 2303 | REAL(KIND=dp) :: t679, t682, t7, t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, & | ^ note: ‘t80’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2572:34: 2572 | + t36*t37/0.4e1_dp | ^ Warning: ‘t8’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2303:71: 2303 | REAL(KIND=dp) :: t679, t682, t7, t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, & | ^ note: ‘t8’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2435:25: 2435 | t215 = t76*gamma | ^ Warning: ‘t76’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2303:62: 2303 | REAL(KIND=dp) :: t679, t682, t7, t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, & | ^ note: ‘t76’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2542:24: 2542 | t504 = t74*t227 | ^ Warning: ‘t74’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2303:57: 2303 | REAL(KIND=dp) :: t679, t682, t7, t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, & | ^ note: ‘t74’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2434:22: 2434 | t213 = t7*t54 | ^ Warning: ‘t7’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2303:37: 2303 | REAL(KIND=dp) :: t679, t682, t7, t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, & | ^ note: ‘t7’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2430:25: 2430 | t205 = t66*gamma | ^ Warning: ‘t66’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2302:58: 2302 | t630, t64, t643, t645, t65, t650, t653, t656, t66, t662, t67, t678 | ^ note: ‘t66’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2440:32: 2440 | t227 = 0.1e1_dp/t65/t29 | ^ Warning: ‘t65’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2302:35: 2302 | t630, t64, t643, t645, t65, t650, t653, t656, t66, t662, t67, t678 | ^ note: ‘t65’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2540:23: 2540 | t500 = t64*t76 | ^ Warning: ‘t64’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2302:18: 2302 | t630, t64, t643, t645, t65, t650, t653, t656, t66, t662, t67, t678 | ^ note: ‘t64’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2439:22: 2439 | t224 = t6*t63 | ^ Warning: ‘t63’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2301:96: 2301 | t57, t574, t575, t578, t58, t597, t598, t6, t600, t61, t612, t614, t615, t62, t627, t63, & | ^ note: ‘t63’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2412:22: 2412 | t161 = t6*rho | ^ Warning: ‘t6’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2301:51: 2301 | t57, t574, t575, t578, t58, t597, t598, t6, t600, t61, t612, t614, t615, t62, t627, t63, & | ^ note: ‘t6’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2413:25: 2413 | t163 = t57*gamma | ^ Warning: ‘t57’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2301:12: 2301 | t57, t574, t575, t578, t58, t597, t598, t6, t600, t61, t612, t614, t615, t62, t627, t63, & | ^ note: ‘t57’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2538:23: 2538 | t496 = t55*t66 | ^ Warning: ‘t55’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2300:81: 2300 | t508, t510, t511, t52, t523, t526, t53, t539, t54, t541, t546, t549, t55, t552, t558, & | ^ note: ‘t55’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2437:26: 2437 | t220 = t6*t54*t27 | ^ Warning: ‘t54’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2300:58: 2300 | t508, t510, t511, t52, t523, t526, t53, t539, t54, t541, t546, t549, t55, t552, t558, & | ^ note: ‘t54’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2425:22: 2425 | t187 = t7*t45 | ^ Warning: ‘t45’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2298:69: 2298 | t413, t42, t426, t428, t43, t433, t436, t439, t44, t445, t45, t46, t461, t462, t465, & | ^ note: ‘t45’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2475:21: 2475 | t310 = R*t43 | ^ Warning: ‘t43’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2298:35: 2298 | t413, t42, t426, t428, t43, t433, t436, t439, t44, t445, t45, t46, t461, t462, t465, & | ^ note: ‘t43’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2420:28: 2420 | t179 = 0.1e1_dp/t41 | ^ Warning: ‘t41’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2297:87: 2297 | t365, t366, t368, t37, t371, t375, t379, t383, t387, t390, t392, t393, t4, t41, t410, & | ^ note: ‘t41’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2533:31: 2533 | - t36*t37*gamma | ^ Warning: ‘t37’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2297:30: 2297 | t365, t366, t368, t37, t371, t375, t379, t383, t387, t390, t392, t393, t4, t41, t410, & | ^ note: ‘t37’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2533:31: 2533 | - t36*t37*gamma | ^ Warning: ‘t36’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2296:97: 2296 | REAL(KIND=dp) :: t318, t319, t330, t333, t336, t337, t340, t348, t35, t353, t356, t357, t36, & | ^ note: ‘t36’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2409:28: 2409 | t154 = 0.1e1_dp/t35 | ^ Warning: ‘t35’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2296:74: 2296 | REAL(KIND=dp) :: t318, t319, t330, t333, t336, t337, t340, t348, t35, t353, t356, t357, t36, & | ^ note: ‘t35’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2427:25: 2427 | t192 = t30*gamma | ^ Warning: ‘t30’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2295:39: 2295 | t287, t29, t292, t294, t3, t30, t302, t305, t308, t31, t310, t315 | ^ note: ‘t30’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2440:32: 2440 | t227 = 0.1e1_dp/t65/t29 | ^ Warning: ‘t29’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2295:18: 2295 | t287, t29, t292, t294, t3, t30, t302, t305, t308, t31, t310, t315 | ^ note: ‘t29’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2536:23: 2536 | t492 = t28*t57 | ^ Warning: ‘t28’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2294:80: 2294 | t237, t238, t24, t25, t26, t264, t267, t27, t270, t271, t274, t275, t28, t280, t285, & | ^ note: ‘t28’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2437:26: 2437 | t220 = t6*t54*t27 | ^ Warning: ‘t27’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2294:51: 2294 | t237, t238, t24, t25, t26, t264, t267, t27, t270, t271, t274, t275, t28, t280, t285, & | ^ note: ‘t27’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2471:42: 2471 | *t110*t275 - t109*t112/t26 | ^ Warning: ‘t26’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2294:34: 2294 | t237, t238, t24, t25, t26, t264, t267, t27, t270, t271, t274, t275, t28, t280, t285, & | ^ note: ‘t26’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2419:49: 2419 | *t4*t144*t19 - t175*t151/0.8e1_dp | ^ Warning: ‘t20’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2292:75: 2292 | t179, t180, t182, t184, t185, t187, t19, t190, t192, t193, t2, t20, t201, t205, t206, & | ^ note: ‘t20’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2419:49: 2419 | *t4*t144*t19 - t175*t151/0.8e1_dp | ^ Warning: ‘t19’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2292:48: 2292 | t179, t180, t182, t184, t185, t187, t19, t190, t192, t193, t2, t20, t201, t205, t206, & | ^ note: ‘t19’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2601:66: 2601 | *t271*t650/0.24e2_dp)*sx | ^ Warning: ‘t138’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2291:37: 2291 | t131, t133, t134, t136, t138, t144, t151, t154, t157, t158, t161, t163, t164, t175, t178, & | ^ note: ‘t138’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2490:76: 2490 | *t337*t138/0.8e1_dp - t348*t271*t302/0.24e2_dp)*sx | ^ Warning: ‘t136’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2291:31: 2291 | t131, t133, t134, t136, t138, t144, t151, t154, t157, t158, t161, t163, t164, t175, t178, & | ^ note: ‘t136’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2490:76: 2490 | *t337*t138/0.8e1_dp - t348*t271*t302/0.24e2_dp)*sx | ^ Warning: ‘t134’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2291:25: 2291 | t131, t133, t134, t136, t138, t144, t151, t154, t157, t158, t161, t163, t164, t175, t178, & | ^ note: ‘t134’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2490:76: 2490 | *t337*t138/0.8e1_dp - t348*t271*t302/0.24e2_dp)*sx | ^ Warning: ‘t133’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2291:19: 2291 | t131, t133, t134, t136, t138, t144, t151, t154, t157, t158, t161, t163, t164, t175, t178, & | ^ note: ‘t133’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2599:36: 2599 | - 0.4e1_dp*t679*t131 | ^ Warning: ‘t131’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2291:13: 2291 | t131, t133, t134, t136, t138, t144, t151, t154, t157, t158, t161, t163, t164, t175, t178, & | ^ note: ‘t131’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2471:42: 2471 | *t110*t275 - t109*t112/t26 | ^ Warning: ‘t13’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:89: 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & | ^ note: ‘t13’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2487:36: 2487 | - 0.4e1_dp*t337*t131 | ^ Warning: ‘t128’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:84: 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & | ^ note: ‘t128’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2599:36: 2599 | - 0.4e1_dp*t679*t131 | ^ Warning: ‘t126’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:78: 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & | ^ note: ‘t126’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2467:25: 2467 | t292 = t180*t125 | ^ Warning: ‘t125’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:72: 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & | ^ note: ‘t125’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2487:36: 2487 | - 0.4e1_dp*t337*t131 | ^ Warning: ‘t124’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:66: 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & | ^ note: ‘t124’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2487:36: 2487 | - 0.4e1_dp*t337*t131 | ^ Warning: ‘t123’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:60: 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & | ^ note: ‘t123’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2591:28: 2591 | *t653)*t121 | ^ Warning: ‘t121’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:54: 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & | ^ note: ‘t121’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2442:24: 2442 | t229 = t228*t12 | ^ Warning: ‘t12’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:48: 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & | ^ note: ‘t12’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2450:25: 2450 | t235 = t234*t118 | ^ Warning: ‘t118’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:37: 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & | ^ note: ‘t118’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2599:36: 2599 | - 0.4e1_dp*t679*t131 | ^ Warning: ‘t117’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:31: 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & | ^ note: ‘t117’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2487:36: 2487 | - 0.4e1_dp*t337*t131 | ^ Warning: ‘t116’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:25: 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & | ^ note: ‘t116’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2460:34: 2460 | t270 = 0.1e1_dp/t115/t114 | ^ Warning: ‘t115’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:19: 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & | ^ note: ‘t115’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2460:34: 2460 | t270 = 0.1e1_dp/t115/t114 | ^ Warning: ‘t114’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:13: 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & | ^ note: ‘t114’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2471:42: 2471 | *t110*t275 - t109*t112/t26 | ^ Warning: ‘t112’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:97: 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & | ^ note: ‘t112’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2588:26: 2588 | *t110*t275 | ^ Warning: ‘t110’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:85: 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & | ^ note: ‘t110’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2588:26: 2588 | *t110*t275 | ^ Warning: ‘t109’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:79: 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & | ^ note: ‘t109’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2464:30: 2464 | t280 = t102*t103*t108 | ^ Warning: ‘t108’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:73: 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & | ^ note: ‘t108’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2465:23: 2465 | t285 = t106**2 | ^ Warning: ‘t106’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:67: 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & | ^ note: ‘t106’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2466:25: 2466 | t287 = t105/t285 | ^ Warning: ‘t105’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:61: 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & | ^ note: ‘t105’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2462:35: 2462 | t274 = t101*t104*t108*t110 | ^ Warning: ‘t104’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:55: 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & | ^ note: ‘t104’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2464:30: 2464 | t280 = t102*t103*t108 | ^ Warning: ‘t103’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:49: 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & | ^ note: ‘t103’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2464:30: 2464 | t280 = t102*t103*t108 | ^ Warning: ‘t102’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:43: 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & | ^ note: ‘t102’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2462:35: 2462 | t274 = t101*t104*t108*t110 | ^ Warning: ‘t101’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:37: 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & | ^ note: ‘t101’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2118:33: 2118 | t301 = t99*t299/0.3e1_dp | ^ Warning: ‘t99’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1953:95: 1953 | t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, t9, t91, t94, t97, t98, t99 | ^ note: ‘t99’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2231:28: 2231 | t614 = t43*t612*t98 | ^ Warning: ‘t98’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1953:90: 1953 | t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, t9, t91, t94, t97, t98, t99 | ^ note: ‘t98’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2225:34: 2225 | + t36*t37/0.4e1_dp | ^ Warning: ‘t9’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1953:70: 1953 | t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, t9, t91, t94, t97, t98, t99 | ^ note: ‘t9’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2102:29: 2102 | t259 = t81*t231*t257 | ^ Warning: ‘t81’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1953:51: 1953 | t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, t9, t91, t94, t97, t98, t99 | ^ note: ‘t81’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2124:24: 2124 | t312 = t80*t231 | ^ Warning: ‘t80’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1953:46: 1953 | t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, t9, t91, t94, t97, t98, t99 | ^ note: ‘t80’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2225:34: 2225 | + t36*t37/0.4e1_dp | ^ Warning: ‘t8’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1953:41: 1953 | t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, t9, t91, t94, t97, t98, t99 | ^ note: ‘t8’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2080:25: 2080 | t211 = t76*gamma | ^ Warning: ‘t76’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1953:32: 1953 | t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, t9, t91, t94, t97, t98, t99 | ^ note: ‘t76’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2192:24: 2192 | t502 = t74*t223 | ^ Warning: ‘t74’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1953:27: 1953 | t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, t9, t91, t94, t97, t98, t99 | ^ note: ‘t74’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2079:22: 2079 | t209 = t7*t54 | ^ Warning: ‘t7’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1952:94: 1952 | REAL(KIND=dp) :: t65, t651, t653, t655, t658, t66, t660, t662, t67, t674, t677, t690, t7, & | ^ note: ‘t7’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2075:25: 2075 | t201 = t66*gamma | ^ Warning: ‘t66’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1952:55: 1952 | REAL(KIND=dp) :: t65, t651, t653, t655, t658, t66, t660, t662, t67, t674, t677, t690, t7, & | ^ note: ‘t66’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2085:32: 2085 | t223 = 0.1e1_dp/t65/t29 | ^ Warning: ‘t65’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1952:26: 1952 | REAL(KIND=dp) :: t65, t651, t653, t655, t658, t66, t660, t662, t67, t674, t677, t690, t7, & | ^ note: ‘t65’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2190:23: 2190 | t498 = t64*t76 | ^ Warning: ‘t64’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1951:70: 1951 | t612, t614, t62, t625, t627, t629, t63, t630, t632, t633, t64, t649 | ^ note: ‘t64’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2084:22: 2084 | t220 = t6*t63 | ^ Warning: ‘t63’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1951:47: 1951 | t612, t614, t62, t625, t627, t629, t63, t630, t632, t633, t64, t649 | ^ note: ‘t63’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2059:22: 2059 | t162 = t6*rho | ^ Warning: ‘t6’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1950:80: 1950 | t547, t549, t55, t552, t554, t556, t568, t57, t571, t58, t584, t599, t6, t600, t601, t61, & | ^ note: ‘t6’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2060:25: 2060 | t164 = t57*gamma | ^ Warning: ‘t57’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1950:53: 1950 | t547, t549, t55, t552, t554, t556, t568, t57, t571, t58, t584, t599, t6, t600, t601, t61, & | ^ note: ‘t57’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2188:23: 2188 | t494 = t55*t66 | ^ Warning: ‘t55’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1950:24: 1950 | t547, t549, t55, t552, t554, t556, t568, t57, t571, t58, t584, t599, t6, t600, t601, t61, & | ^ note: ‘t55’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2082:26: 2082 | t216 = t6*t54*t27 | ^ Warning: ‘t54’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1949:82: 1949 | t502, t503, t506, t508, t519, t52, t521, t523, t524, t526, t527, t53, t54, t543, t545, & | ^ note: ‘t54’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2070:22: 2070 | t183 = t7*t45 | ^ Warning: ‘t45’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1947:81: 1947 | t411, t412, t42, t428, t43, t430, t432, t434, t437, t439, t44, t441, t45, t453, t456, & | ^ note: ‘t45’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2094:28: 2094 | t230 = t43*t228*t98 | ^ Warning: ‘t43’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1947:35: 1947 | t411, t412, t42, t428, t43, t430, t432, t434, t437, t439, t44, t441, t45, t453, t456, & | ^ note: ‘t43’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2067:28: 2067 | t180 = 0.1e1_dp/t41 | ^ Warning: ‘t41’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1946:93: 1946 | t365, t367, t37, t371, t375, t379, t383, t386, t388, t4, t404, t406, t408, t409, t41, & | ^ note: ‘t41’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2183:31: 2183 | - t36*t37*gamma | ^ Warning: ‘t37’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1946:24: 1946 | t365, t367, t37, t371, t375, t379, t383, t386, t388, t4, t404, t406, t408, t409, t41, & | ^ note: ‘t37’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2183:31: 2183 | - t36*t37*gamma | ^ Warning: ‘t36’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1945:85: 1945 | REAL(KIND=dp) :: t313, t321, t326, t329, t339, t343, t35, t351, t354, t355, t36, t363, t364, & | ^ note: ‘t36’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2056:28: 2056 | t155 = 0.1e1_dp/t35 | ^ Warning: ‘t35’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1945:62: 1945 | REAL(KIND=dp) :: t313, t321, t326, t329, t339, t343, t35, t351, t354, t355, t36, t363, t364, & | ^ note: ‘t35’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2072:25: 2072 | t188 = t30*gamma | ^ Warning: ‘t30’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1944:28: 1944 | t297, t299, t3, t30, t301, t303, t306, t307, t308, t31, t310, t312 | ^ note: ‘t30’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2085:32: 2085 | t223 = 0.1e1_dp/t65/t29 | ^ Warning: ‘t29’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1943:93: 1943 | t26, t261, t262, t263, t265, t266, t269, t27, t272, t273, t278, t28, t283, t285, t29, & | ^ note: ‘t29’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2186:23: 2186 | t490 = t28*t57 | ^ Warning: ‘t28’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1943:76: 1943 | t26, t261, t262, t263, t265, t266, t269, t27, t272, t273, t278, t28, t283, t285, t29, & | ^ note: ‘t28’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2082:26: 2082 | t216 = t6*t54*t27 | ^ Warning: ‘t27’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1943:53: 1943 | t26, t261, t262, t263, t265, t266, t269, t27, t272, t273, t278, t28, t283, t285, t29, & | ^ note: ‘t27’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2116:42: 2116 | *t110*t273 - t109*t112/t26 | ^ Warning: ‘t26’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1943:12: 1943 | t26, t261, t262, t263, t265, t266, t269, t27, t272, t273, t278, t28, t283, t285, t29, & | ^ note: ‘t26’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2066:49: 2066 | *t4*t145*t19 - t176*t152/0.8e1_dp | ^ Warning: ‘t20’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1941:57: 1941 | t182, t183, t186, t188, t189, t19, t197, t2, t20, t201, t202, t205, t206, t209, t211, & | ^ note: ‘t20’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2066:49: 2066 | *t4*t145*t19 - t176*t152/0.8e1_dp | ^ Warning: ‘t19’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1941:42: 1941 | t182, t183, t186, t188, t189, t19, t197, t2, t20, t201, t202, t205, t206, t209, t211, & | ^ note: ‘t19’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2137:56: 2137 | - t139*t269*t297/0.24e2_dp)*sx | ^ Warning: ‘t139’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1940:25: 1940 | t135, t138, t139, t145, t152, t155, t158, t159, t162, t164, t165, t176, t179, t180, t181, & | ^ note: ‘t139’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2137:56: 2137 | - t139*t269*t297/0.24e2_dp)*sx | ^ Warning: ‘t138’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1940:19: 1940 | t135, t138, t139, t145, t152, t155, t158, t159, t162, t164, t165, t176, t179, t180, t181, & | ^ note: ‘t138’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2135:25: 2135 | /0.3e1_dp | ^ Warning: ‘t135’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1940:13: 1940 | t135, t138, t139, t145, t152, t155, t158, t159, t162, t164, t165, t176, t179, t180, t181, & | ^ note: ‘t135’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2135:25: 2135 | /0.3e1_dp | ^ Warning: ‘t134’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:95: 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & | ^ note: ‘t134’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2249:70: 2249 | t674 = (-t601 - t614 + t627 - t629 - t630 + t633 + t653)*t132 | ^ Warning: ‘t132’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:89: 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & | ^ note: ‘t132’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2116:42: 2116 | *t110*t273 - t109*t112/t26 | ^ Warning: ‘t13’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:83: 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & | ^ note: ‘t13’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2256:25: 2256 | /0.3e1_dp | ^ Warning: ‘t129’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:78: 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & | ^ note: ‘t129’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2135:25: 2135 | /0.3e1_dp | ^ Warning: ‘t125’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:72: 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & | ^ note: ‘t125’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2069:25: 2069 | t182 = t181*t124 | ^ Warning: ‘t124’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:66: 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & | ^ note: ‘t124’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2135:25: 2135 | /0.3e1_dp | ^ Warning: ‘t123’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:60: 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & | ^ note: ‘t123’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2245:69: 2245 | t655 = (t601 + t614 - t627 - t629 - t630 + t633 + t653)*t121 | ^ Warning: ‘t121’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:54: 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & | ^ note: ‘t121’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2087:24: 2087 | t225 = t224*t12 | ^ Warning: ‘t12’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:48: 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & | ^ note: ‘t12’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2104:25: 2104 | t262 = t230*t118 | ^ Warning: ‘t118’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:37: 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & | ^ note: ‘t118’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2106:27: 2106 | t265 = t117*R*t257 | ^ Warning: ‘t117’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:31: 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & | ^ note: ‘t117’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2137:56: 2137 | - t139*t269*t297/0.24e2_dp)*sx | ^ Warning: ‘t116’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:25: 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & | ^ note: ‘t116’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2108:45: 2108 | t269 = REAL(t100, KIND=dp)/t115/t114 | ^ Warning: ‘t115’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:19: 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & | ^ note: ‘t115’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2108:45: 2108 | t269 = REAL(t100, KIND=dp)/t115/t114 | ^ Warning: ‘t114’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:13: 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & | ^ note: ‘t114’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2116:42: 2116 | *t110*t273 - t109*t112/t26 | ^ Warning: ‘t112’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:97: 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & | ^ note: ‘t112’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2242:26: 2242 | *t110*t273 | ^ Warning: ‘t110’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:85: 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & | ^ note: ‘t110’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2242:26: 2242 | *t110*t273 | ^ Warning: ‘t109’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:79: 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & | ^ note: ‘t109’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2111:30: 2111 | t278 = t102*t103*t108 | ^ Warning: ‘t108’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:73: 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & | ^ note: ‘t108’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2112:23: 2112 | t283 = t106**2 | ^ Warning: ‘t106’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:67: 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & | ^ note: ‘t106’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2113:25: 2113 | t285 = t105/t283 | ^ Warning: ‘t105’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:61: 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & | ^ note: ‘t105’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2109:35: 2109 | t272 = t101*t104*t108*t110 | ^ Warning: ‘t104’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:55: 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & | ^ note: ‘t104’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2111:30: 2111 | t278 = t102*t103*t108 | ^ Warning: ‘t103’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:49: 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & | ^ note: ‘t103’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2111:30: 2111 | t278 = t102*t103*t108 | ^ Warning: ‘t102’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:43: 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & | ^ note: ‘t102’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2109:35: 2109 | t272 = t101*t104*t108*t110 | ^ Warning: ‘t101’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:37: 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & | ^ note: ‘t101’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1666:33: 1666 | t232 = 0.1e1_dp/t100/t99 | ^ Warning: ‘t99’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1527:22: 1527 | t96, t97, t99 | ^ note: ‘t99’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1722:46: 1722 | (-t385 - t341 + t387)*t95*t237 | ^ Warning: ‘t97’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1527:17: 1527 | t96, t97, t99 | ^ note: ‘t97’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1802:88: 1802 | - t580 + t618)*t95*t237 | ^ Warning: ‘t95’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:95: 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & | ^ note: ‘t95’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1802:88: 1802 | - t580 + t618)*t95*t237 | ^ Warning: ‘t94’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:90: 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & | ^ note: ‘t94’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1722:46: 1722 | (-t385 - t341 + t387)*t95*t237 | ^ Warning: ‘t93’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:85: 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & | ^ note: ‘t93’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1672:22: 1672 | t247 = t91**2 | ^ Warning: ‘t91’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:80: 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & | ^ note: ‘t91’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1673:24: 1673 | t249 = t90/t247 | ^ Warning: ‘t90’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:75: 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & | ^ note: ‘t90’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1623:23: 1623 | t134 = t133*t9 | ^ Warning: ‘t9’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:70: 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & | ^ note: ‘t9’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1668:23: 1668 | t234 = t86*t89 | ^ Warning: ‘t89’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:66: 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & | ^ note: ‘t89’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1671:27: 1671 | t242 = t87*t88*t93 | ^ Warning: ‘t88’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:61: 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & | ^ note: ‘t88’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1671:27: 1671 | t242 = t87*t88*t93 | ^ Warning: ‘t87’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:56: 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & | ^ note: ‘t87’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1668:23: 1668 | t234 = t86*t89 | ^ Warning: ‘t86’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:51: 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & | ^ note: ‘t86’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1679:31: 1679 | t267 = t84*t233*R*t264 | ^ Warning: ‘t84’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:41: 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & | ^ note: ‘t84’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1789:28: 1789 | t580 = t23*t578*t83 | ^ Warning: ‘t83’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:36: 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & | ^ note: ‘t83’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1684:24: 1684 | t280 = t108*t66 | ^ Warning: ‘t66’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1525:53: 1525 | t629, t638, t65, t654, t655, t656, t659, t66, t67, t70, t73, t76 | ^ note: ‘t66’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1814:57: 1814 | + t581 - t596 - t655 - 0.4e1_dp*t656*t116 | ^ Warning: ‘t65’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1525:24: 1525 | t629, t638, t65, t654, t655, t656, t659, t66, t67, t70, t73, t76 | ^ note: ‘t65’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1641:25: 1641 | t177 = t61*gamma | ^ Warning: ‘t61’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1524:50: 1524 | t58, t580, t581, t59, t593, t596, t6, t61, t612, t613, t614, t616, t618, t62, t623, t626, & | ^ note: ‘t61’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1795:21: 1795 | t612 = t3*t6 | ^ Warning: ‘t6’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1524:45: 1524 | t58, t580, t581, t59, t593, t596, t6, t61, t612, t613, t614, t616, t618, t62, t623, t626, & | ^ note: ‘t6’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1749:24: 1749 | t462 = t59*t189 | ^ Warning: ‘t59’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1524:29: 1524 | t58, t580, t581, t59, t593, t596, t6, t61, t612, t613, t614, t616, t618, t62, t623, t626, & | ^ note: ‘t59’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1636:25: 1636 | t167 = t51*gamma | ^ Warning: ‘t51’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1522:90: 1522 | t466, t468, t469, t47, t48, t481, t484, t487, t49, t5, t50, t501, t504, t506, t51, t511, & | ^ note: ‘t51’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1646:32: 1646 | t189 = 0.1e1_dp/t50/t32 | ^ Warning: ‘t50’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1522:67: 1522 | t466, t468, t469, t47, t48, t481, t484, t487, t49, t5, t50, t501, t504, t506, t51, t511, & | ^ note: ‘t50’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1640:22: 1640 | t175 = t5*t39 | ^ Warning: ‘t5’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1522:62: 1522 | t466, t468, t469, t47, t48, t481, t484, t487, t49, t5, t50, t501, t504, t506, t51, t511, & | ^ note: ‘t5’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1747:23: 1747 | t458 = t49*t61 | ^ Warning: ‘t49’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1522:58: 1522 | t466, t468, t469, t47, t48, t481, t484, t487, t49, t5, t50, t501, t504, t506, t51, t511, & | ^ note: ‘t49’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1645:22: 1645 | t186 = t4*t48 | ^ Warning: ‘t48’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1522:35: 1522 | t466, t468, t469, t47, t48, t481, t484, t487, t49, t5, t50, t501, t504, t506, t51, t511, & | ^ note: ‘t48’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1633:25: 1633 | t159 = t42*gamma | ^ Warning: ‘t42’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1520:74: 1520 | t385, t387, t39, t392, t395, t398, t4, t40, t402, t404, t409, t42, t420, t427, t428, & | ^ note: ‘t42’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1745:23: 1745 | t454 = t40*t51 | ^ Warning: ‘t40’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1520:51: 1520 | t385, t387, t39, t392, t395, t398, t4, t40, t402, t404, t409, t42, t420, t427, t428, & | ^ note: ‘t40’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1632:22: 1632 | t157 = t4*rho | ^ Warning: ‘t4’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1520:46: 1520 | t385, t387, t39, t392, t395, t398, t4, t40, t402, t404, t409, t42, t420, t427, t428, & | ^ note: ‘t4’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1643:26: 1643 | t182 = t4*t39*t30 | ^ Warning: ‘t39’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1520:24: 1520 | t385, t387, t39, t392, t395, t398, t4, t40, t402, t404, t409, t42, t420, t427, t428, & | ^ note: ‘t39’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1622:25: 1622 | t133 = t33*gamma | ^ Warning: ‘t33’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1518:70: 1518 | t302, t31, t310, t314, t315, t317, t318, t32, t324, t328, t33 | ^ note: ‘t33’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1646:32: 1646 | t189 = 0.1e1_dp/t50/t32 | ^ Warning: ‘t32’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1518:53: 1518 | t302, t31, t310, t314, t315, t317, t318, t32, t324, t328, t33 | ^ note: ‘t32’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1743:23: 1743 | t450 = t31*t42 | ^ Warning: ‘t31’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1518:18: 1518 | t302, t31, t310, t314, t315, t317, t318, t32, t324, t328, t33 | ^ note: ‘t31’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1664:25: 1664 | t186*t191 | ^ Warning: ‘t30’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1517:97: 1517 | t264, t267, t27, t270, t272, t277, t28, t280, t281, t29, t292, t295, t298, t299, t3, t30, & | ^ note: ‘t30’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1630:22: 1630 | t153 = t4*t29 | ^ Warning: ‘t29’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1517:64: 1517 | t264, t267, t27, t270, t272, t277, t28, t280, t281, t29, t292, t295, t298, t299, t3, t30, & | ^ note: ‘t29’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1682:21: 1682 | t272 = R*t23 | ^ Warning: ‘t23’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1516:29: 1516 | t22, t226, t229, t23, t232, t233, t234, t235, t237, t24, t242, t247, t249, t254, t256, & | ^ note: ‘t23’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1625:22: 1625 | t138 = t21**2 | ^ Warning: ‘t21’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1515:93: 1515 | t178, t18, t182, t183, t186, t189, t190, t191, t194, t196, t197, t199, t2, t200, t21, & | ^ note: ‘t21’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1620:22: 1620 | t128 = t5*t17 | ^ Warning: ‘t17’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1514:71: 1514 | t146, t153, t154, t157, t159, t16, t160, t163, t167, t168, t17, t171, t172, t175, t177, & | ^ note: ‘t17’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1816:66: 1816 | *t233*t623/0.24e2_dp)*sx | ^ Warning: ‘t123’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1513:43: 1513 | t115, t116, t118, t119, t121, t123, t128, t131, t133, t134, t137, t138, t140, t141, t143, & | ^ note: ‘t123’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1697:76: 1697 | *t299*t123/0.8e1_dp - t310*t233*t264/0.24e2_dp)*sx | ^ Warning: ‘t121’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1513:37: 1513 | t115, t116, t118, t119, t121, t123, t128, t131, t133, t134, t137, t138, t140, t141, t143, & | ^ note: ‘t121’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1697:76: 1697 | *t299*t123/0.8e1_dp - t310*t233*t264/0.24e2_dp)*sx | ^ Warning: ‘t119’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1513:31: 1513 | t115, t116, t118, t119, t121, t123, t128, t131, t133, t134, t137, t138, t140, t141, t143, & | ^ note: ‘t119’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1697:76: 1697 | *t299*t123/0.8e1_dp - t310*t233*t264/0.24e2_dp)*sx | ^ Warning: ‘t118’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1513:25: 1513 | t115, t116, t118, t119, t121, t123, t128, t131, t133, t134, t137, t138, t140, t141, t143, & | ^ note: ‘t118’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1814:57: 1814 | + t581 - t596 - t655 - 0.4e1_dp*t656*t116 | ^ Warning: ‘t116’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1513:19: 1513 | t115, t116, t118, t119, t121, t123, t128, t131, t133, t134, t137, t138, t140, t141, t143, & | ^ note: ‘t116’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1694:36: 1694 | - 0.4e1_dp*t299*t116 | ^ Warning: ‘t113’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:96: 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & | ^ note: ‘t113’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1814:57: 1814 | + t581 - t596 - t655 - 0.4e1_dp*t656*t116 | ^ Warning: ‘t111’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:90: 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & | ^ note: ‘t111’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1785:38: 1785 | t566 = t3*t443*t140*t110*t103 | ^ Warning: ‘t110’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:84: 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & | ^ note: ‘t110’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1694:36: 1694 | - 0.4e1_dp*t299*t116 | ^ Warning: ‘t109’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:78: 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & | ^ note: ‘t109’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1694:36: 1694 | - 0.4e1_dp*t299*t116 | ^ Warning: ‘t108’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:72: 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & | ^ note: ‘t108’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1805:37: 1805 | /0.3e1_dp*t626)*t106 | ^ Warning: ‘t106’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:66: 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & | ^ note: ‘t106’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1785:38: 1785 | t566 = t3*t443*t140*t110*t103 | ^ Warning: ‘t103’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:54: 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & | ^ note: ‘t103’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1814:57: 1814 | + t581 - t596 - t655 - 0.4e1_dp*t656*t116 | ^ Warning: ‘t102’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:48: 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & | ^ note: ‘t102’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1771:25: 1771 | t525 = t143*t101 | ^ Warning: ‘t101’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:42: 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & | ^ note: ‘t101’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1666:33: 1666 | t232 = 0.1e1_dp/t100/t99 | ^ Warning: ‘t100’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:36: 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & | ^ note: ‘t100’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1678:86: 1678 | t256)*t95*t237 - t94*t97/t29 | ^ Warning: ‘t10’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:30: 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & | ^ note: ‘t10’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1328:43: 1328 | t231 = REAL(t85, KIND=dp)/t100/t99 | ^ Warning: ‘t99’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1189:51: 1189 | t9, t90, t91, t93, t94, t95, t96, t97, t99 | ^ note: ‘t99’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1384:50: 1384 | t94*(-t317 - t340 + t358)*t95*t235 | ^ Warning: ‘t97’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1189:46: 1189 | t9, t90, t91, t93, t94, t95, t96, t97, t99 | ^ note: ‘t97’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1466:88: 1466 | - t587 + t600)*t95*t235 | ^ Warning: ‘t95’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1189:36: 1189 | t9, t90, t91, t93, t94, t95, t96, t97, t99 | ^ note: ‘t95’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1466:88: 1466 | - t587 + t600)*t95*t235 | ^ Warning: ‘t94’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1189:31: 1189 | t9, t90, t91, t93, t94, t95, t96, t97, t99 | ^ note: ‘t94’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1384:50: 1384 | t94*(-t317 - t340 + t358)*t95*t235 | ^ Warning: ‘t93’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1189:26: 1189 | t9, t90, t91, t93, t94, t95, t96, t97, t99 | ^ note: ‘t93’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1333:22: 1333 | t245 = t91**2 | ^ Warning: ‘t91’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1189:21: 1189 | t9, t90, t91, t93, t94, t95, t96, t97, t99 | ^ note: ‘t91’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1334:24: 1334 | t247 = t90/t245 | ^ Warning: ‘t90’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1189:16: 1189 | t9, t90, t91, t93, t94, t95, t96, t97, t99 | ^ note: ‘t90’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1283:23: 1283 | t135 = t134*t9 | ^ Warning: ‘t9’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1189:11: 1189 | t9, t90, t91, t93, t94, t95, t96, t97, t99 | ^ note: ‘t9’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1329:23: 1329 | t232 = t86*t89 | ^ Warning: ‘t89’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1188:97: 1188 | REAL(KIND=dp) :: t66, t67, t672, t70, t73, t76, t79, t82, t83, t84, t85, t86, t87, t88, t89, & | ^ note: ‘t89’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1332:27: 1332 | t240 = t87*t88*t93 | ^ Warning: ‘t88’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1188:92: 1188 | REAL(KIND=dp) :: t66, t67, t672, t70, t73, t76, t79, t82, t83, t84, t85, t86, t87, t88, t89, & | ^ note: ‘t88’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1332:27: 1332 | t240 = t87*t88*t93 | ^ Warning: ‘t87’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1188:87: 1188 | REAL(KIND=dp) :: t66, t67, t672, t70, t73, t76, t79, t82, t83, t84, t85, t86, t87, t88, t89, & | ^ note: ‘t87’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1329:23: 1329 | t232 = t86*t89 | ^ Warning: ‘t86’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1188:82: 1188 | REAL(KIND=dp) :: t66, t67, t672, t70, t73, t76, t79, t82, t83, t84, t85, t86, t87, t88, t89, & | ^ note: ‘t86’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1339:33: 1339 | t263 = t84*t261/0.3e1_dp | ^ Warning: ‘t84’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1188:72: 1188 | REAL(KIND=dp) :: t66, t67, t672, t70, t73, t76, t79, t82, t83, t84, t85, t86, t87, t88, t89, & | ^ note: ‘t84’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1455:28: 1455 | t587 = t23*t585*t83 | ^ Warning: ‘t83’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1188:67: 1188 | REAL(KIND=dp) :: t66, t67, t672, t70, t73, t76, t79, t82, t83, t84, t85, t86, t87, t88, t89, & | ^ note: ‘t83’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1322:29: 1322 | t221 = t66*t193*t219 | ^ Warning: ‘t66’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1188:26: 1188 | REAL(KIND=dp) :: t66, t67, t672, t70, t73, t76, t79, t82, t83, t84, t85, t86, t87, t88, t89, & | ^ note: ‘t66’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1394:35: 1394 | t414 = ndrho*t141*t65*t114 | ^ Warning: ‘t65’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1187:70: 1187 | t609, t61, t62, t628, t630, t632, t634, t639, t641, t645, t65, t655 | ^ note: ‘t65’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1300:25: 1300 | t173 = t61*gamma | ^ Warning: ‘t61’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1187:18: 1187 | t609, t61, t62, t628, t630, t632, t634, t639, t641, t645, t65, t655 | ^ note: ‘t61’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1451:35: 1451 | t574 = t3*t6*t572/0.9e1_dp | ^ Warning: ‘t6’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1186:73: 1186 | t548, t56, t563, t57, t572, t574, t58, t585, t587, t59, t598, t6, t600, t605, t606, t608, & | ^ note: ‘t6’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1414:24: 1414 | t471 = t59*t185 | ^ Warning: ‘t59’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1186:63: 1186 | t548, t56, t563, t57, t572, t574, t58, t585, t587, t59, t598, t6, t600, t605, t606, t608, & | ^ note: ‘t59’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1295:25: 1295 | t163 = t51*gamma | ^ Warning: ‘t51’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1185:27: 1185 | t499, t5, t50, t51, t516, t518, t52, t520, t522, t525, t526, t527, t530, t532, t545, & | ^ note: ‘t51’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1305:32: 1305 | t185 = 0.1e1_dp/t50/t32 | ^ Warning: ‘t50’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1185:22: 1185 | t499, t5, t50, t51, t516, t518, t52, t520, t522, t525, t526, t527, t530, t532, t545, & | ^ note: ‘t50’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1359:22: 1359 | t312 = t5*t33 | ^ Warning: ‘t5’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1185:17: 1185 | t499, t5, t50, t51, t516, t518, t52, t520, t522, t525, t526, t527, t530, t532, t545, & | ^ note: ‘t5’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1412:23: 1412 | t467 = t49*t61 | ^ Warning: ‘t49’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1184:64: 1184 | t467, t468, t47, t471, t472, t475, t477, t48, t488, t49, t490, t493, t494, t496, t497, & | ^ note: ‘t49’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1304:22: 1304 | t182 = t4*t48 | ^ Warning: ‘t48’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1184:53: 1184 | t467, t468, t47, t471, t472, t475, t477, t48, t488, t49, t490, t493, t494, t496, t497, & | ^ note: ‘t48’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1292:25: 1292 | t155 = t42*gamma | ^ Warning: ‘t42’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1183:18: 1183 | t414, t42, t423, t426, t43, t434, t443, t450, t455, t456, t459, t46, t460, t463, t464, & | ^ note: ‘t42’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1410:23: 1410 | t463 = t40*t51 | ^ Warning: ‘t40’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1182:73: 1182 | t367, t37, t38, t388, t39, t390, t392, t394, t397, t399, t4, t40, t403, t405, t409, t410, & | ^ note: ‘t40’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1291:22: 1291 | t153 = t4*rho | ^ Warning: ‘t4’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1182:68: 1182 | t367, t37, t38, t388, t39, t390, t392, t394, t397, t399, t4, t40, t403, t405, t409, t410, & | ^ note: ‘t4’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1302:26: 1302 | t178 = t4*t39*t30 | ^ Warning: ‘t39’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1182:34: 1182 | t367, t37, t38, t388, t39, t390, t392, t394, t397, t399, t4, t40, t403, t405, t409, t410, & | ^ note: ‘t39’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1282:25: 1282 | t134 = t33*gamma | ^ Warning: ‘t33’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1180:70: 1180 | t305, t31, t312, t314, t315, t317, t319, t32, t323, t327, t33 | ^ note: ‘t33’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1305:32: 1305 | t185 = 0.1e1_dp/t50/t32 | ^ Warning: ‘t32’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1180:53: 1180 | t305, t31, t312, t314, t315, t317, t319, t32, t323, t327, t33 | ^ note: ‘t32’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1408:23: 1408 | t459 = t31*t42 | ^ Warning: ‘t31’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1180:18: 1180 | t305, t31, t312, t314, t315, t317, t319, t32, t323, t327, t33 | ^ note: ‘t31’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1321:25: 1321 | t182*t187 | ^ Warning: ‘t30’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1179:91: 1179 | t265, t268, t269, t27, t270, t272, t274, t275, t28, t283, t288, t29, t291, t3, t30, t301, & | ^ note: ‘t30’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1289:22: 1289 | t149 = t4*t29 | ^ Warning: ‘t29’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1179:76: 1179 | t265, t268, t269, t27, t270, t272, t274, t275, t28, t283, t288, t29, t291, t3, t30, t301, & | ^ note: ‘t29’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1314:28: 1314 | t192 = t23*t190*t83 | ^ Warning: ‘t23’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1178:30: 1178 | t225, t227, t228, t23, t231, t232, t233, t235, t24, t240, t245, t247, t259, t261, t263, & | ^ note: ‘t23’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1285:22: 1285 | t139 = t21**2 | ^ Warning: ‘t21’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1177:63: 1177 | t18, t182, t185, t186, t187, t190, t192, t193, t2, t21, t219, t22, t221, t223, t224, & | ^ note: ‘t21’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1280:22: 1280 | t129 = t5*t17 | ^ Warning: ‘t17’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1176:65: 1176 | t153, t155, t156, t159, t16, t163, t164, t167, t168, t17, t171, t173, t174, t178, t179, & | ^ note: ‘t17’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1358:56: 1358 | - t124*t231*t259/0.24e2_dp)*sx | ^ Warning: ‘t124’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1175:31: 1175 | t119, t120, t123, t124, t129, t132, t134, t135, t138, t139, t141, t142, t143, t149, t150, & | ^ note: ‘t124’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1358:56: 1358 | - t124*t231*t259/0.24e2_dp)*sx | ^ Warning: ‘t123’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1175:25: 1175 | t119, t120, t123, t124, t129, t132, t134, t135, t138, t139, t141, t142, t143, t149, t150, & | ^ note: ‘t123’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1356:25: 1356 | /0.3e1_dp | ^ Warning: ‘t120’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1175:19: 1175 | t119, t120, t123, t124, t129, t132, t134, t135, t138, t139, t141, t142, t143, t149, t150, & | ^ note: ‘t120’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1356:25: 1356 | /0.3e1_dp | ^ Warning: ‘t119’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1175:13: 1175 | t119, t120, t123, t124, t129, t132, t134, t135, t138, t139, t141, t142, t143, t149, t150, & | ^ note: ‘t119’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1473:70: 1473 | t655 = (-t574 - t587 + t600 - t605 - t606 + t609 + t632)*t117 | ^ Warning: ‘t117’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:96: 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & | ^ note: ‘t117’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1479:54: 1479 | *t114 - t301*t608 - t120*t630/0.3e1_dp | ^ Warning: ‘t114’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:90: 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & | ^ note: ‘t114’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1356:25: 1356 | /0.3e1_dp | ^ Warning: ‘t110’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:84: 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & | ^ note: ‘t110’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1460:47: 1460 | t605 = t3*t450*t141*t109*t103/0.9e1_dp | ^ Warning: ‘t109’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:78: 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & | ^ note: ‘t109’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1356:25: 1356 | /0.3e1_dp | ^ Warning: ‘t108’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:72: 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & | ^ note: ‘t108’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1469:69: 1469 | t634 = (t574 + t587 - t600 - t605 - t606 + t609 + t632)*t106 | ^ Warning: ‘t106’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:66: 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & | ^ note: ‘t106’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1460:47: 1460 | t605 = t3*t450*t141*t109*t103/0.9e1_dp | ^ Warning: ‘t103’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:54: 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & | ^ note: ‘t103’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1326:27: 1326 | t227 = t102*R*t219 | ^ Warning: ‘t102’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:48: 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & | ^ note: ‘t102’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1358:56: 1358 | - t124*t231*t259/0.24e2_dp)*sx | ^ Warning: ‘t101’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:42: 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & | ^ note: ‘t101’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1328:43: 1328 | t231 = REAL(t85, KIND=dp)/t100/t99 | ^ Warning: ‘t100’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:36: 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & | ^ note: ‘t100’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1337:86: 1337 | t221)*t95*t235 - t94*t97/t29 | ^ Warning: ‘t10’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:30: 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & | ^ note: ‘t10’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:959:23: 959 | t204 = t203*t9 | ^ Warning: ‘t9’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:989:125: 989 | *t237/0.2e1_dp - t86*t103*t265*t111/0.2e1_dp))*sx | ^ Warning: ‘t86’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:941:24: 941 | t160 = t85*t103 | ^ Warning: ‘t85’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:952:25: 952 | t190 = t81*gamma | ^ Warning: ‘t81’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1026:24: 1026 | t399 = t79*t202 | ^ Warning: ‘t79’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:947:25: 947 | t180 = t71*gamma | ^ Warning: ‘t71’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:957:32: 957 | t202 = 0.1e1_dp/t70/t35 | ^ Warning: ‘t70’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1024:23: 1024 | t395 = t69*t81 | ^ Warning: ‘t69’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:956:22: 956 | t199 = t3*t68 | ^ Warning: ‘t68’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:932:25: 932 | t142 = t62*gamma | ^ Warning: ‘t62’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1022:23: 1022 | t391 = t60*t71 | ^ Warning: ‘t60’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1043:32: 1043 | t42*t43/0.4e1_dp | ^ Warning: ‘t6’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1007:58: 1007 | *t313 - 0.80e2_dp/0.729e3_dp*t99*t195*t317 | ^ Warning: ‘t59’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1015:22: 1015 | t376 = t5*t36 | ^ Warning: ‘t5’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:976:22: 976 | t245 = t49**2 | ^ Warning: ‘t49’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:939:28: 939 | t158 = 0.1e1_dp/t47 | ^ Warning: ‘t47’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1018:31: 1018 | - t42*t43*gamma | ^ Warning: ‘t43’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:934:23: 934 | t154 = t42*t23 | ^ Warning: ‘t42’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:929:28: 929 | t134 = 0.1e1_dp/t41 | ^ Warning: ‘t41’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:994:51: 994 | ndrho/0.9e1_dp + t154*t285/0.4e1_dp | ^ Warning: ‘t4’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:944:25: 944 | t167 = t36*gamma | ^ Warning: ‘t36’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:957:32: 957 | t202 = 0.1e1_dp/t70/t35 | ^ Warning: ‘t35’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1020:23: 1020 | t387 = t34*t62 | ^ Warning: ‘t34’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:928:40: 928 | t131 = 0.1e1_dp/t4/t33*gamma*t9 | ^ Warning: ‘t33’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:930:22: 930 | t137 = t3*t32 | ^ Warning: ‘t32’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:989:125: 989 | *t237/0.2e1_dp - t86*t103*t265*t111/0.2e1_dp))*sx | ^ Warning: ‘t3’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:938:53: 938 | t42*t23*t124*t16 - t154*t131/0.8e1_dp | ^ Warning: ‘t26’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1043:32: 1043 | t42*t43/0.4e1_dp | ^ Warning: ‘t25’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:977:29: 977 | t248 = t21*t106/t245 | ^ Warning: ‘t21’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:974:21: 974 | *t204 | ^ Warning: ‘t19’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:942:22: 942 | t162 = t4*t17 | ^ Warning: ‘t17’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:938:53: 938 | t42*t23*t124*t16 - t154*t131/0.8e1_dp | ^ Warning: ‘t16’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1058:72: 1058 | /0.2e1_dp))*sx | ^ Warning: ‘t117’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1058:72: Warning: ‘t115’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1058:72: Warning: ‘t112’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1058:72: Warning: ‘t111’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:989:125: 989 | *t237/0.2e1_dp - t86*t103*t265*t111/0.2e1_dp))*sx | ^ Warning: ‘t110’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:978:25: 978 | t249 = t109*t102 | ^ Warning: ‘t109’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:979:29: 979 | t255 = t21*t106*t108 | ^ Warning: ‘t108’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:989:125: 989 | *t237/0.2e1_dp - t86*t103*t265*t111/0.2e1_dp))*sx | ^ Warning: ‘t107’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1058:72: 1058 | /0.2e1_dp))*sx | ^ Warning: ‘t106’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1052:53: 1052 | t487 = t459*t160 + t472*t103 - t86*t211*t484 | ^ Warning: ‘t103’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:989:125: 989 | *t237/0.2e1_dp - t86*t103*t265*t111/0.2e1_dp))*sx | ^ Warning: ‘t102’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: 802 | + t71*t234*t448/0.2e1_dp - t71*t88*t471*t96/0.2e1_dp))*sx | ^ Warning: ‘t97’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: Warning: ‘t96’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:729:74: 729 | *t199/0.2e1_dp - t71*t88*t227*t96/0.2e1_dp))*sx | ^ Warning: ‘t95’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: 802 | + t71*t234*t448/0.2e1_dp - t71*t88*t471*t96/0.2e1_dp))*sx | ^ Warning: ‘t94’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:719:27: 719 | t217 = t21*t91*t93 | ^ Warning: ‘t93’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:729:74: 729 | *t199/0.2e1_dp - t71*t88*t227*t96/0.2e1_dp))*sx | ^ Warning: ‘t92’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: 802 | + t71*t234*t448/0.2e1_dp - t71*t88*t471*t96/0.2e1_dp))*sx | ^ Warning: ‘t91’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:699:23: 699 | t166 = t165*t9 | ^ Warning: ‘t9’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:792:24: 792 | t436 = t435*t88 | ^ Warning: ‘t88’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:729:74: 729 | *t199/0.2e1_dp - t71*t88*t227*t96/0.2e1_dp))*sx | ^ Warning: ‘t87’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:729:74: Warning: ‘t71’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:731:24: 731 | t249 = t120*t70 | ^ Warning: ‘t70’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:692:25: 692 | t152 = t66*gamma | ^ Warning: ‘t66’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:768:24: 768 | t361 = t64*t164 | ^ Warning: ‘t64’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:687:25: 687 | t142 = t56*gamma | ^ Warning: ‘t56’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:697:32: 697 | t164 = 0.1e1_dp/t55/t37 | ^ Warning: ‘t55’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:766:23: 766 | t357 = t54*t66 | ^ Warning: ‘t54’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:696:22: 696 | t161 = t3*t53 | ^ Warning: ‘t53’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:757:22: 757 | t340 = t5*t38 | ^ Warning: ‘t5’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:684:25: 684 | t134 = t47*gamma | ^ Warning: ‘t47’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:764:23: 764 | t353 = t45*t56 | ^ Warning: ‘t45’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:745:58: 745 | *t267 - 0.80e2_dp/0.729e3_dp*t84*t157*t271 | ^ Warning: ‘t44’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:730:22: 730 | t246 = t4*t38 | ^ Warning: ‘t4’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: 802 | + t71*t234*t448/0.2e1_dp - t71*t88*t471*t96/0.2e1_dp))*sx | ^ Warning: ‘t38’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:697:32: 697 | t164 = 0.1e1_dp/t55/t37 | ^ Warning: ‘t37’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:762:23: 762 | t349 = t36*t47 | ^ Warning: ‘t36’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:694:26: 694 | t157 = t3*t44*t35 | ^ Warning: ‘t35’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:756:46: 756 | /0.2e1_dp))*sx | ^ Warning: ‘t34’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:729:74: 729 | *t199/0.2e1_dp - t71*t88*t227*t96/0.2e1_dp))*sx | ^ Warning: ‘t3’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:716:22: 716 | t207 = t28**2 | ^ Warning: ‘t28’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:678:22: 678 | t118 = t26**2 | ^ Warning: ‘t26’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: 802 | + t71*t234*t448/0.2e1_dp - t71*t88*t471*t96/0.2e1_dp))*sx | ^ Warning: ‘t21’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:714:21: 714 | *t166 | ^ Warning: ‘t19’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:673:22: 673 | t108 = t4*t17 | ^ Warning: ‘t17’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: 802 | + t71*t234*t448/0.2e1_dp - t71*t88*t471*t96/0.2e1_dp))*sx | ^ Warning: ‘t102’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: Warning: ‘t101’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: Warning: ‘t100’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_xbecke_roussel.mod' due to: xc_xbecke_roussel.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke_roussel.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod mathconstants.mod bibliography.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_xbecke88_lr_adiabatic.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_array_utils.mod mathconstants.mod bibliography.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F xc_xbecke88_lr_adiabatic.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:58:39 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xbecke88_lr_adiabatic.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xbecke88_lr_adiabatic.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: 4613 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: ‘t997’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3175:30: 3175 | t99, t991, t995, t997, xx | ^ note: ‘t997’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5160:54: 5160 | t5487 = 0.2160000000e3_dp*t7*t995*t1652 | ^ Warning: ‘t995’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3175:24: 3175 | t99, t991, t995, t997, xx | ^ note: ‘t995’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: 4613 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: ‘t991’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3175:18: 3175 | t99, t991, t995, t997, xx | ^ note: ‘t991’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5031:34: 5031 | *t105*t5118 | ^ Warning: ‘t99’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3175:12: 3175 | t99, t991, t995, t997, xx | ^ note: ‘t99’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: 4613 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: ‘t987’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:95: 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: ‘t987’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4603:29: 4603 | *t3339 | ^ Warning: ‘t984’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:89: 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: ‘t984’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t980’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:77: 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: ‘t980’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5190:50: 5190 | t5564 = 0.1173333333e3_dp*t5060*t98 | ^ Warning: ‘t98’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:71: 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: ‘t98’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4637:33: 4637 | *t339*t969 | ^ Warning: ‘t976’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:60: 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: ‘t976’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4629:39: 4629 | *t321*t953*t1625 | ^ Warning: ‘t974’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:48: 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: ‘t974’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4637:33: 4637 | *t339*t969 | ^ Warning: ‘t973’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:42: 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: ‘t973’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3510:30: 3510 | t627 = t97*t132 | ^ Warning: ‘t97’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:30: 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: ‘t97’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4637:33: 4637 | *t339*t969 | ^ Warning: ‘t969’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:25: 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: ‘t969’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t966’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:19: 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: ‘t966’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4603:29: 4603 | *t3339 | ^ Warning: ‘t963’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:13: 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: ‘t963’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4637:33: 4637 | *t339*t969 | ^ Warning: ‘t962’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3173:92: 3173 | REAL(kind=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & | ^ note: ‘t962’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4603:29: 4603 | *t3339 | ^ Warning: ‘t959’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3173:86: 3173 | REAL(kind=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & | ^ note: ‘t959’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t955’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3173:74: 3173 | REAL(kind=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & | ^ note: ‘t955’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5201:56: 5201 | t5593 = 0.1066666667e2_dp*t321*t953*t5087 | ^ Warning: ‘t953’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3173:62: 3173 | REAL(kind=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & | ^ note: ‘t953’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4637:33: 4637 | *t339*t969 | ^ Warning: ‘t950’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3173:56: 3173 | REAL(kind=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & | ^ note: ‘t950’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3383:38: 3383 | t341 = 0.1e1_dp/t19/t95 | ^ Warning: ‘t95’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3173:50: 3173 | REAL(kind=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & | ^ note: ‘t95’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5207:56: 5207 | t5607 = 0.5866666667e2_dp*t307*t949*t5069 | ^ Warning: ‘t949’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3173:45: 3173 | REAL(kind=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & | ^ note: ‘t949’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t946’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3173:39: 3173 | REAL(kind=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & | ^ note: ‘t946’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4629:39: 4629 | *t321*t953*t1625 | ^ Warning: ‘t941’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:76: 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: ‘t941’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4615:31: 4615 | t3682 = t24*t940 | ^ Warning: ‘t940’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:70: 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: ‘t940’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4238:70: 4238 | *t371 - 0.4266666668e2_dp*t2220/t1014/t94*t1058 | ^ Warning: ‘t94’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:64: 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: ‘t94’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4637:33: 4637 | *t339*t969 | ^ Warning: ‘t930’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:59: 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: ‘t930’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5189:50: 5189 | t5562 = 0.5866666667e2_dp*t93*t4820 | ^ Warning: ‘t93’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:53: 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: ‘t93’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t929’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:48: 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: ‘t929’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4665:39: 4665 | *t165*t3865*t237 | ^ Warning: ‘t922’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:30: 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: ‘t922’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3362:29: 3362 | t298 = t92*t97 | ^ Warning: ‘t92’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:24: 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: ‘t92’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4851:39: 4851 | *t289*t294*t1553 | ^ Warning: ‘t918’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:19: 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: ‘t918’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4859:42: 4859 | *t83*t45*t3581*t140 | ^ Warning: ‘t914’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:13: 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: ‘t914’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4798:66: 4798 | *t1410 - 0.1666666667e0_dp*t429*t1392*t1410 | ^ Warning: ‘t907’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:94: 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: ‘t907’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4651:71: 4651 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 | ^ Warning: ‘t906’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:88: 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: ‘t906’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3961:39: 3961 | t1640 = 0.1e1_dp/t787/t9 | ^ Warning: ‘t9’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:76: 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: ‘t9’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5442:57: 5442 | t6216 = 0.8333333340e-1_dp*t429*t897*t4701 | ^ Warning: ‘t897’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:72: 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: ‘t897’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4870:96: 4870 | t3869 + t4657 + t4696) | ^ Warning: ‘t893’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:60: 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: ‘t893’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4719:70: 4719 | *t508*t1769 - 0.1111111112e0_dp*t192*t1837*t267 | ^ Warning: ‘t886’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:48: 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: ‘t886’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4719:70: 4719 | *t508*t1769 - 0.1111111112e0_dp*t192*t1837*t267 | ^ Warning: ‘t882’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:42: 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: ‘t882’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3521:49: 3521 | *t615 - 0.20e1_dp*t102*t646 | ^ Warning: ‘t88’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:30: 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: ‘t88’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4782:66: 4782 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 | ^ Warning: ‘t878’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:25: 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: ‘t878’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4762:66: 4762 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 | ^ Warning: ‘t874’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:13: 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: ‘t874’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3517:73: 3517 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 | ^ Warning: ‘t87’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:93: 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: ‘t87’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4726:37: 4726 | *t58*t3796*t71 | ^ Warning: ‘t866’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:82: 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: ‘t866’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4755:41: 4755 | t192*t68*t4256*t65 | ^ Warning: ‘t865’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:76: 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: ‘t865’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4712:66: 4712 | *t1722 + 0.3703703706e0_dp*t1193*t1505*t451 | ^ Warning: ‘t864’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:70: 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: ‘t864’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4762:66: 4762 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 | ^ Warning: ‘t863’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:64: 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: ‘t863’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4497:80: 4497 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 | ^ Warning: ‘t86’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:52: 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: ‘t86’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4747:29: 4747 | *t3382 | ^ Warning: ‘t859’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:47: 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: ‘t859’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4559:56: 4559 | t3497 = 0.2400000000e2_dp*t473*t852*t1483 | ^ Warning: ‘t852’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:29: 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: ‘t852’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4238:70: 4238 | *t371 - 0.4266666668e2_dp*t2220/t1014/t94*t1058 | ^ Warning: ‘t85’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:17: 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: ‘t85’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3485:108: 3485 | t46*t541))*sx | ^ Warning: ‘t84’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:12: 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: ‘t84’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4833:71: 4833 | *t3507 - t3512)*t149*t160 | ^ Warning: ‘t833’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:94: 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: ‘t833’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5426:37: 5426 | t6175 = t83*t597*t1688 | ^ Warning: ‘t83’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:88: 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: ‘t83’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4555:38: 4555 | t165*t171*t3449 | ^ Warning: ‘t827’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:83: 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: ‘t827’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4682:40: 4682 | *t400*t1333*t1410 | ^ Warning: ‘t822’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:71: 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: ‘t822’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4555:38: 4555 | t165*t171*t3449 | ^ Warning: ‘t815’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:65: 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: ‘t815’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4870:96: 4870 | t3869 + t4657 + t4696) | ^ Warning: ‘t804’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:59: 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: ‘t804’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t801’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:53: 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: ‘t801’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t800’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:47: 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: ‘t800’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3558:118: 3558 | *t83*t653 - 0.2222222224e0_dp*t144*t46*t739))*sx | ^ Warning: ‘t8’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:41: 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: ‘t8’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4536:32: 4536 | t12*t1058 | ^ Warning: ‘t797’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:37: 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: ‘t797’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3485:108: 3485 | t46*t541))*sx | ^ Warning: ‘t79’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:95: 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: ‘t79’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4879:42: 4879 | t4721 = 0.1e1_dp/t787*t2480 | ^ Warning: ‘t787’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:90: 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: ‘t787’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4927:59: 4927 | - 0.2400000000e2_dp*t786/t2492*t1058 | ^ Warning: ‘t786’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:84: 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: ‘t786’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4536:32: 4536 | t12*t1058 | ^ Warning: ‘t782’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:72: 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: ‘t782’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4516:85: 4516 | + t3288) | ^ Warning: ‘t78’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:66: 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: ‘t78’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4670:32: 4670 | t3925 = t777*t561 | ^ Warning: ‘t777’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:61: 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: ‘t777’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4603:29: 4603 | *t3339 | ^ Warning: ‘t773’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:49: 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: ‘t773’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4629:39: 4629 | *t321*t953*t1625 | ^ Warning: ‘t772’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:43: 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: ‘t772’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t769’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:37: 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: ‘t769’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4542:57: 4542 | *t102*t3363 - 0.20e1_dp*t102*t3379 | ^ Warning: ‘t766’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:31: 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: ‘t766’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: 4613 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: ‘t764’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:19: 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: ‘t764’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4870:96: 4870 | t3869 + t4657 + t4696) | ^ Warning: ‘t754’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:13: 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: ‘t754’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4870:96: 4870 | t3869 + t4657 + t4696) | ^ Warning: ‘t753’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:95: 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t753’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4884:55: 4884 | t4732 = 0.6666666672e0_dp*t747*t84*t4729 | ^ Warning: ‘t747’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:89: 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t747’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3433:29: 3433 | t446 = t74*rho | ^ Warning: ‘t74’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:83: 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t74’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3991:31: 3991 | t1694 = t45*t739 | ^ Warning: ‘t739’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:78: 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t739’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4791:39: 4791 | *t429*t1928*t290 | ^ Warning: ‘t735’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:72: 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t735’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5379:33: 5379 | t6053 = t732*t6052 | ^ Warning: ‘t732’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:66: 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t732’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5344:51: 5344 | t5977 = 0.1111111112e0_dp*t1755*t729 | ^ Warning: ‘t729’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:60: 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t729’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4712:66: 4712 | *t1722 + 0.3703703706e0_dp*t1193*t1505*t451 | ^ Warning: ‘t728’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:54: 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t728’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5386:33: 5386 | t6075 = t723*t6052 | ^ Warning: ‘t723’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:48: 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t723’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5557:54: 5557 | + t5949 + t5952 + t5954 - t5958 | ^ Warning: ‘t722’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:42: 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t722’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5357:33: 5357 | t6006 = t719*t1838 | ^ Warning: ‘t719’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:36: 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t719’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5065:90: 5065 | t729 - 0.5555555558e-1_dp*t192*t5271 - 0.5000000001e0_dp*t732*t4908 | ^ Warning: ‘t716’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:30: 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t716’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4003:31: 4003 | t1715 = t713*t67 | ^ Warning: ‘t713’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:24: 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t713’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4049:51: 4049 | t1797 = 0.8999999998e1_dp*t1795*t710 | ^ Warning: ‘t710’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:18: 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t710’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3549:87: 3549 | t200 - 0.5555555558e-1_dp*t192*t729 - 0.5000000001e0_dp*t732*t709 | ^ Warning: ‘t71’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:12: 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t71’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4040:51: 4040 | t1779 = 0.5000000001e0_dp*t1777*t709 | ^ Warning: ‘t709’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:93: 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: ‘t709’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5065:90: 5065 | t729 - 0.5555555558e-1_dp*t192*t5271 - 0.5000000001e0_dp*t732*t4908 | ^ Warning: ‘t708’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:87: 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: ‘t708’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4197:33: 4197 | t2114 = t707*t2113 | ^ Warning: ‘t707’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:81: 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: ‘t707’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5384:42: 5384 | t6066 = t1519*t705*t561*t65 | ^ Warning: ‘t705’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:75: 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: ‘t705’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: ‘t70’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:69: 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: ‘t70’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3374:29: 3374 | t321 = t7*t219 | ^ Warning: ‘t7’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:64: 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: ‘t7’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4451:30: 4451 | t3097 = t66*t69 | ^ Warning: ‘t69’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:60: 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: ‘t69’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4118:56: 4118 | t1952 = 0.5555555557e-1_dp*t165*t689*t433 | ^ Warning: ‘t689’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:55: 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: ‘t689’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3419:30: 3419 | t406 = t68*t140 | ^ Warning: ‘t68’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:49: 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: ‘t68’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4907:73: 4907 | *t165*t166*t4729 + 0.3333333334e0_dp*t55*t57*t4782 | ^ Warning: ‘t679’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:44: 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: ‘t679’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5592:76: 5592 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) | ^ Warning: ‘t673’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:38: 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: ‘t673’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5418:38: 5418 | t6160 = t147*t1885*t672 | ^ Warning: ‘t672’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:32: 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: ‘t672’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4139:55: 4139 | t1997 = 0.1666666667e0_dp*t165*t171*t668 | ^ Warning: ‘t668’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3165:76: 3165 | t6603, t6611, t6620, t6621, t6630, t6640, t6658, t6665, t6669, t668 | ^ note: ‘t668’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3458:30: 3458 | t516 = t66*t515 | ^ Warning: ‘t66’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3164:92: 3164 | t650, t6509, t6529, t653, t6539, t6554, t6557, t6569, t657, t658, t6583, t6596, t66, & | ^ note: ‘t66’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5414:38: 5414 | t6141 = t658*t575*t1925 | ^ Warning: ‘t658’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3164:73: 3164 | t650, t6509, t6529, t653, t6539, t6554, t6557, t6569, t657, t658, t6583, t6596, t66, & | ^ note: ‘t658’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3990:49: 3990 | t1693 = 0.3333333336e0_dp*t55*t653 | ^ Warning: ‘t653’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3164:33: 3164 | t650, t6509, t6529, t653, t6539, t6554, t6557, t6569, t657, t658, t6583, t6596, t66, & | ^ note: ‘t653’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3903:49: 3903 | t1545 = 0.3333333336e0_dp*t55*t650 | ^ Warning: ‘t650’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3164:13: 3164 | t650, t6509, t6529, t653, t6539, t6554, t6557, t6569, t657, t658, t6583, t6596, t66, & | ^ note: ‘t650’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3497:59: 3497 | *t71 - 0.5000000001e0_dp*t60*t561*t65 | ^ Warning: ‘t65’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3163:93: 3163 | t6415, t6428, t6433, t6442, t645, t6451, t646, t6461, t6479, t649, t6490, t6499, t65, & | ^ note: ‘t65’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4096:31: 4096 | t1902 = t68*t649 | ^ Warning: ‘t649’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3163:74: 3163 | t6415, t6428, t6433, t6442, t645, t6451, t646, t6461, t6479, t649, t6490, t6499, t65, & | ^ note: ‘t649’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5031:34: 5031 | *t105*t5118 | ^ Warning: ‘t646’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3163:54: 3163 | t6415, t6428, t6433, t6442, t645, t6451, t646, t6461, t6479, t649, t6490, t6499, t65, & | ^ note: ‘t646’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5197:53: 5197 | t5579 = 0.80e1_dp*t102*t327*t645*t1443 | ^ Warning: ‘t645’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3163:41: 3163 | t6415, t6428, t6433, t6442, t645, t6451, t646, t6461, t6479, t649, t6490, t6499, t65, & | ^ note: ‘t645’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4169:32: 4169 | t2054 = t786*t640 | ^ Warning: ‘t640’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3162:88: 3162 | t6344, t635, t6352, t6363, t6367, t637, t6370, t6373, t6375, t6380, t6389, t640, t6400, & | ^ note: ‘t640’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5024:66: 5024 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 | ^ Warning: ‘t637’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3162:47: 3162 | t6344, t635, t6352, t6363, t6367, t637, t6370, t6373, t6375, t6380, t6389, t640, t6400, & | ^ note: ‘t637’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5024:66: 5024 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 | ^ Warning: ‘t635’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3162:20: 3162 | t6344, t635, t6352, t6363, t6367, t637, t6370, t6373, t6375, t6380, t6389, t640, t6400, & | ^ note: ‘t635’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5024:66: 5024 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 | ^ Warning: ‘t628’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3161:40: 3161 | t6267, t6268, t627, t6271, t628, t6281, t6283, t6290, t6291, t63, t6308, t6338, t6339, & | ^ note: ‘t628’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5157:51: 5157 | t5480 = 0.1760000000e3_dp*t5060*t627 | ^ Warning: ‘t627’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3161:27: 3161 | t6267, t6268, t627, t6271, t628, t6281, t6283, t6290, t6291, t63, t6308, t6338, t6339, & | ^ note: ‘t627’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5200:56: 5200 | t5590 = 0.80e1_dp*t624*t22*t326*t136*t233 | ^ Warning: ‘t624’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3160:41: 3160 | t6219, t6222, t6223, t6227, t624, t6247, t6249, t6252, t6253, t6256, t6257, t6260, t6263, & | ^ note: ‘t624’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3450:35: 3450 | *t61*t262*t25 | ^ Warning: ‘t62’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3159:61: 3159 | REAL(kind=dp) :: t6186, t6189, t6192, t6194, t6198, t62, t6201, t6207, t6210, t6213, t6216, & | ^ note: ‘t62’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5031:34: 5031 | *t105*t5118 | ^ Warning: ‘t615’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3157:96: 3157 | t6112, t6116, t6119, t6123, t6126, t6129, t6132, t6136, t6138, t614, t6141, t6144, t615, & | ^ note: ‘t615’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3940:32: 3940 | t1608 = t953*t614 | ^ Warning: ‘t614’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3157:76: 3157 | t6112, t6116, t6119, t6123, t6126, t6129, t6132, t6136, t6138, t614, t6141, t6144, t615, & | ^ note: ‘t614’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3345:34: 3345 | t264 = t61*t262*t17 | ^ Warning: ‘t61’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3156:73: 3156 | t6078, t6079, t608, t6087, t609, t6090, t6091, t6094, t6099, t61, t6102, t6106, t6109, & | ^ note: ‘t61’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5031:34: 5031 | *t105*t5118 | ^ Warning: ‘t609’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3156:40: 3156 | t6078, t6079, t608, t6087, t609, t6090, t6091, t6094, t6099, t61, t6102, t6106, t6109, & | ^ note: ‘t609’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3929:32: 3929 | t1592 = t949*t608 | ^ Warning: ‘t608’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3156:27: 3156 | t6078, t6079, t608, t6087, t609, t6090, t6091, t6094, t6099, t61, t6102, t6106, t6109, & | ^ note: ‘t608’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t605’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3155:34: 3155 | t6044, t6047, t6049, t605, t6052, t6053, t6056, t6058, t6060, t6063, t6066, t6074, t6075, & | ^ note: ‘t605’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4037:31: 4037 | t1774 = t60*t496 | ^ Warning: ‘t60’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3153:64: 3153 | t5977, t5978, t598, t5985, t5990, t5994, t5996, t6, t60, t6000, t6002, t6004, t6006, & | ^ note: ‘t60’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3393:30: 3393 | t365 = t6*ndrho | ^ Warning: ‘t6’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3153:59: 3153 | t5977, t5978, t598, t5985, t5990, t5994, t5996, t6, t60, t6000, t6002, t6004, t6006, & | ^ note: ‘t6’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3902:49: 3902 | t1543 = 0.3333333336e0_dp*t55*t598 | ^ Warning: ‘t598’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3153:27: 3153 | t5977, t5978, t598, t5985, t5990, t5994, t5996, t6, t60, t6000, t6002, t6004, t6006, & | ^ note: ‘t598’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5426:37: 5426 | t6175 = t83*t597*t1688 | ^ Warning: ‘t597’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3152:76: 3152 | REAL(kind=dp) :: t5954, t5956, t5958, t5960, t5963, t5964, t5966, t597, t5971, t5973, t5975, & | ^ note: ‘t597’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4135:56: 4135 | t1987 = 0.8333333335e-1_dp*t429*t437*t593 | ^ Warning: ‘t593’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3151:20: 3151 | t5929, t593, t5932, t5938, t5940, t5942, t5944, t5949, t5952 | ^ note: ‘t593’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3840:50: 3840 | t1408 = 0.4444444448e0_dp*t214*t590 | ^ Warning: ‘t590’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3150:32: 3150 | t5891, t5898, t59, t590, t5902, t5905, t5908, t5911, t5913, t5918, t5922, t5925, t5926, & | ^ note: ‘t590’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3534:30: 3534 | t707 = t187*t59 | ^ Warning: ‘t59’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3150:26: 3150 | t5891, t5898, t59, t590, t5902, t5905, t5908, t5911, t5913, t5918, t5922, t5925, t5926, & | ^ note: ‘t59’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4917:60: 4917 | t4812 = 0.1333333334e1_dp*t217*t46*t589*t1447 | ^ Warning: ‘t589’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3149:97: 3149 | t5850, t5854, t5857, t5861, t5864, t5868, t5869, t5875, t5880, t5881, t5885, t5888, t589, & | ^ note: ‘t589’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4122:31: 4122 | t1962 = t585*rho | ^ Warning: ‘t585’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3148:97: 3148 | t5819, t5822, t5825, t5828, t5830, t5831, t5833, t5835, t5838, t5841, t5845, t5848, t585, & | ^ note: ‘t585’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3348:30: 3348 | t268 = t58*t237 | ^ Warning: ‘t58’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3147:53: 3147 | t5786, t5789, t579, t5792, t5795, t5797, t58, t5801, t5804, t5807, t5810, t5813, t5816, & | ^ note: ‘t58’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4782:66: 4782 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 | ^ Warning: ‘t579’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3147:27: 3147 | t5786, t5789, t579, t5792, t5795, t5797, t58, t5801, t5804, t5807, t5810, t5813, t5816, & | ^ note: ‘t579’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4186:39: 4186 | t2081*t575*t2082 | ^ Warning: ‘t575’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3146:34: 3146 | t5742, t5745, t5749, t575, t5752, t5756, t5760, t5767, t5770, t5773, t5776, t5780, t5783, & | ^ note: ‘t575’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3619:69: 3619 | *t170*t455*t17 + 0.3333333334e0_dp*t55*t57*t889 | ^ Warning: ‘t57’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3144:53: 3144 | t569, t5692, t5695, t5696, t5698, t5699, t57, t5701, t5705 | ^ note: ‘t57’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5481:36: 5481 | t5011 + t5001 | ^ Warning: ‘t569’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3144:13: 3144 | t569, t5692, t5695, t5696, t5698, t5699, t57, t5701, t5705 | ^ note: ‘t569’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4907:73: 4907 | *t165*t166*t4729 + 0.3333333334e0_dp*t55*t57*t4782 | ^ Warning: ‘t567’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3143:41: 3143 | t5660, t5663, t5666, t5667, t567, t5670, t5671, t5673, t5676, t5679, t5682, t5686, t5689, & | ^ note: ‘t567’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4117:56: 4117 | t1946 = 0.1666666667e0_dp*t165*t1392*t561 | ^ Warning: ‘t561’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3141:60: 3141 | t5595, t5597, t56, t5600, t5602, t5604, t5607, t561, t5610, t5611, t5613, t5619, t5622, & | ^ note: ‘t561’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3445:30: 3445 | t479 = t56*t140 | ^ Warning: ‘t56’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3141:26: 3141 | t5595, t5597, t56, t5600, t5602, t5604, t5607, t561, t5610, t5611, t5613, t5619, t5622, & | ^ note: ‘t56’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5031:34: 5031 | *t105*t5118 | ^ Warning: ‘t558’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3140:68: 3140 | t5564, t5565, t5568, t557, t5572, t5574, t5575, t5579, t558, t5581, t5585, t5590, t5593, & | ^ note: ‘t558’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5493:79: 5493 | *t327*t2057*t557 - t5456 + t5459 - t5462 + t5466 - t5468 | ^ Warning: ‘t557’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3140:34: 3140 | t5564, t5565, t5568, t557, t5572, t5574, t5575, t5579, t558, t5581, t5585, t5590, t5593, & | ^ note: ‘t557’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5024:66: 5024 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 | ^ Warning: ‘t550’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3138:27: 3138 | REAL(kind=dp) :: t550, t5503, t5507, t5509, t551, t5511, t5516, t5523, t5525, t5528, t5531, & | ^ note: ‘t550’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5084:55: 5084 | t5301 = 0.3333333336e0_dp*t55*t384*t4729 | ^ Warning: ‘t55’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3137:75: 3137 | t5480, t5482, t5484, t5487, t5489, t5492, t5494, t5496, t5499, t55 | ^ note: ‘t55’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3701:31: 3701 | t1071 = t45*t541 | ^ Warning: ‘t541’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3134:83: 3134 | t5376, t5379, t5383, t5386, t5389, t5397, t5400, t5402, t5406, t5409, t541, t5412, t5415, & | ^ note: ‘t541’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4497:80: 4497 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 | ^ Warning: ‘t537’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3133:76: 3133 | t5343, t5345, t5347, t5351, t5354, t5357, t5360, t5363, t5367, t537, t5370, t5371, t5373, & | ^ note: ‘t537’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4450:69: 4450 | *(t199)*(t2281) - 0.1851851853e0_dp*t508*t1201 | ^ Warning: ‘t534’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3132:90: 3132 | t5314, t5317, t5320, t5323, t5326, t5329, t5330, t5333, t5335, t5338, t5339, t534, t5342, & | ^ note: ‘t534’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4463:34: 4463 | *t503*t2312 | ^ Warning: ‘t531’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3131:87: 3131 | REAL(kind=dp) :: t5294, t5295, t5298, t53, t530, t5301, t5303, t5305, t5308, t531, t5311, & | ^ note: ‘t531’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4463:34: 4463 | *t503*t2312 | ^ Warning: ‘t530’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3131:53: 3131 | REAL(kind=dp) :: t5294, t5295, t5298, t53, t530, t5301, t5303, t5305, t5308, t531, t5311, & | ^ note: ‘t530’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4014:51: 4014 | t1735 = 0.3703703705e-1_dp*t719*t527 | ^ Warning: ‘t527’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3130:26: 3130 | t526, t5262, t527, t5270, t5271, t5276, t5280, t5281, t5284, t5291 | ^ note: ‘t527’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4472:64: 4472 | *t2622*t71 - 0.1666666668e0_dp*t1106*t886 | ^ Warning: ‘t526’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3130:13: 3130 | t526, t5262, t527, t5270, t5271, t5276, t5280, t5281, t5284, t5291 | ^ note: ‘t526’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: ‘t520’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3129:40: 3129 | t5163, t517, t5170, t5174, t520, t5226, t5228, t5229, t5237, t5244, t5247, t5251, t5256, & | ^ note: ‘t520’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: ‘t517’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3129:20: 3129 | t5163, t517, t5170, t5174, t520, t5226, t5228, t5229, t5237, t5244, t5247, t5251, t5256, & | ^ note: ‘t517’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4726:37: 4726 | *t58*t3796*t71 | ^ Warning: ‘t516’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3128:94: 3128 | t5108, t511, t5115, t5118, t512, t5122, t5123, t5126, t5139, t5143, t5147, t515, t516, & | ^ note: ‘t516’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: ‘t515’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3128:88: 3128 | t5108, t511, t5115, t5118, t512, t5122, t5123, t5126, t5139, t5143, t5147, t515, t516, & | ^ note: ‘t515’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4463:34: 4463 | *t503*t2312 | ^ Warning: ‘t512’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3128:40: 3128 | t5108, t511, t5115, t5118, t512, t5122, t5123, t5126, t5139, t5143, t5147, t515, t516, & | ^ note: ‘t512’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3756:32: 3756 | t1213 = t511*t225 | ^ Warning: ‘t511’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3128:20: 3128 | t5108, t511, t5115, t5118, t512, t5122, t5123, t5126, t5139, t5143, t5147, t515, t516, & | ^ note: ‘t511’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5380:52: 5380 | t6056 = 0.5555555558e-1_dp*t508*t5271 | ^ Warning: ‘t508’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3127:76: 3127 | t5043, t5044, t5047, t5050, t5051, t5060, t5065, t5069, t5079, t508, t5083, t5087, t5106, & | ^ note: ‘t508’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4774:64: 4774 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 | ^ Warning: ‘t503’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3126:69: 3126 | t5011, t5013, t5016, t5019, t5022, t5025, t5028, t5029, t503, t5032, t5035, t5036, t5040, & | ^ note: ‘t503’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3712:31: 3712 | t1106 = t500*t67 | ^ Warning: ‘t500’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3125:58: 3125 | t4955, t4958, t496, t498, t4994, t4995, t50, t500, t5001, t5002, t5005, t5008, t5009, & | ^ note: ‘t500’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4295:40: 4295 | *t1368*t166*t2160 | ^ Warning: ‘t50’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3125:52: 3125 | t4955, t4958, t496, t498, t4994, t4995, t50, t500, t5001, t5002, t5005, t5008, t5009, & | ^ note: ‘t50’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4450:69: 4450 | *(t199)*(t2281) - 0.1851851853e0_dp*t508*t1201 | ^ Warning: ‘t498’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3125:33: 3125 | t4955, t4958, t496, t498, t4994, t4995, t50, t500, t5001, t5002, t5005, t5008, t5009, & | ^ note: ‘t498’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: ‘t496’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3125:27: 3125 | t4955, t4958, t496, t498, t4994, t4995, t50, t500, t5001, t5002, t5005, t5008, t5009, & | ^ note: ‘t496’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3341:30: 3341 | t245*t17 | ^ Warning: ‘t49’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3122:67: 3122 | t4884, t4887, t4889, t489, t4893, t4895, t4897, t4898, t49, t4901, t4904, t4905, t4907, & | ^ note: ‘t49’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4439:76: 4439 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 | ^ Warning: ‘t489’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3122:34: 3122 | t4884, t4887, t4889, t489, t4893, t4895, t4897, t4898, t49, t4901, t4904, t4905, t4907, & | ^ note: ‘t489’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3358:35: 3358 | t289 = rho*t48*omega | ^ Warning: ‘t48’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3120:12: 3120 | t48, t4800, t4801, t4804, t4808, t4812, t4817, t4820, t4829, t4830, t4833, t4834, t4837, & | ^ note: ‘t48’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4430:33: 4430 | t1176*t804 | ^ Warning: ‘t479’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3119:68: 3119 | t4770, t4771, t4772, t4776, t478, t4782, t4786, t4789, t479, t4790, t4793, t4796, t4797, & | ^ note: ‘t479’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4946:39: 4946 | t4895 = t478*t1500*t4729 | ^ Warning: ‘t478’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3119:41: 3119 | t4770, t4771, t4772, t4776, t478, t4782, t4786, t4789, t479, t4790, t4793, t4796, t4797, & | ^ note: ‘t478’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4430:33: 4430 | t1176*t804 | ^ Warning: ‘t474’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3118:48: 3118 | t4733, t4734, t4736, t4738, t4739, t474, t4743, t4744, t4748, t4760, t4764, t4768, t4769, & | ^ note: ‘t474’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5469:45: 5469 | *t4901 - t4907 + t4911 | ^ Warning: ‘t473’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3117:88: 3117 | REAL(kind=dp) :: t471, t4713, t4714, t4717, t472, t4721, t4725, t4726, t4729, t473, t4732, & | ^ note: ‘t473’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4058:32: 4058 | t1821 = t472*t262 | ^ Warning: ‘t472’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3117:54: 3117 | REAL(kind=dp) :: t471, t4713, t4714, t4717, t472, t4721, t4725, t4726, t4729, t473, t4732, & | ^ note: ‘t472’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5550:29: 5550 | *t6271 | ^ Warning: ‘t471’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3117:27: 3117 | REAL(kind=dp) :: t471, t4713, t4714, t4717, t472, t4721, t4725, t4726, t4729, t473, t4732, & | ^ note: ‘t471’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3789:40: 3789 | t1300 = 0.1e1_dp/t41/t470 | ^ Warning: ‘t470’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3116:38: 3116 | t4657, t466, t4696, t47, t470, t4700, t4701, t4704, t4707, t4708 | ^ note: ‘t470’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3415:30: 3415 | t399 = t47*t398 | ^ Warning: ‘t47’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3116:32: 3116 | t4657, t466, t4696, t47, t470, t4700, t4701, t4704, t4707, t4708 | ^ note: ‘t47’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4366:104: 4366 | *t394) + 0.5000000001e0_dp*t165*t2720*t237 | ^ Warning: ‘t466’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3116:20: 3116 | t4657, t466, t4696, t47, t470, t4700, t4701, t4704, t4707, t4708 | ^ note: ‘t466’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4381:40: 4381 | *t2763*t446*t2779 | ^ Warning: ‘t462’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3115:85: 3115 | t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, t4627, & | ^ note: ‘t462’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3485:108: 3485 | t46*t541))*sx | ^ Warning: ‘t46’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3115:72: 3115 | t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, t4627, & | ^ note: ‘t46’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4295:40: 4295 | *t1368*t166*t2160 | ^ Warning: ‘t455’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3115:46: 3115 | t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, t4627, & | ^ note: ‘t455’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: ‘t451’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3115:26: 3115 | t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, t4627, & | ^ note: ‘t451’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4366:104: 4366 | *t394) + 0.5000000001e0_dp*t165*t2720*t237 | ^ Warning: ‘t450’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3115:13: 3115 | t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, t4627, & | ^ note: ‘t450’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4497:80: 4497 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 | ^ Warning: ‘t446’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3114:77: 3114 | t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, t4498, t45, & | ^ note: ‘t446’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5415:38: 5415 | t6144 = t445*t4512*t668 | ^ Warning: ‘t445’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3114:71: 3114 | t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, t4498, t45, & | ^ note: ‘t445’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4369:33: 4369 | t2763 = t1367*t444 | ^ Warning: ‘t444’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3114:65: 3114 | t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, t4498, t45, & | ^ note: ‘t444’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4497:80: 4497 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 | ^ Warning: ‘t437’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3114:33: 3114 | t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, t4498, t45, & | ^ note: ‘t437’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4418:57: 4418 | - 0.5000000001e0_dp*t429*t437*t914 | ^ Warning: ‘t433’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3114:13: 3114 | t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, t4498, t45, & | ^ note: ‘t433’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4870:96: 4870 | t3869 + t4657 + t4696) | ^ Warning: ‘t43’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3113:85: 3113 | t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, t4317, & | ^ note: ‘t43’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5413:38: 5413 | t6138 = t429*t1928*t593 | ^ Warning: ‘t429’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3113:73: 3113 | t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, t4317, & | ^ note: ‘t429’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4520:30: 4520 | t3305 = t4*t428 | ^ Warning: ‘t428’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3113:67: 3113 | t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, t4317, & | ^ note: ‘t428’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5409:56: 5409 | t6126 = 0.1800000000e2_dp*t658*t4764*t425 | ^ Warning: ‘t425’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3113:33: 3113 | t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, t4317, & | ^ note: ‘t425’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4418:57: 4418 | - 0.5000000001e0_dp*t429*t437*t914 | ^ Warning: ‘t424’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3113:27: 3113 | t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, t4317, & | ^ note: ‘t424’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3408:31: 3408 | t383 = t42*omega | ^ Warning: ‘t42’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3112:90: 3112 | t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, t4201, & | ^ note: ‘t42’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4405:65: 4405 | *t2869 - 0.6000000000e1_dp*t405*t2873*t237 | ^ Warning: ‘t417’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3112:85: 3112 | t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, t4201, & | ^ note: ‘t417’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4497:80: 4497 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 | ^ Warning: ‘t413’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3112:65: 3112 | t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, t4201, & | ^ note: ‘t413’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3562:38: 3562 | t747 = lambda*t41*omega | ^ Warning: ‘t41’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3112:45: 3112 | t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, t4201, & | ^ note: ‘t41’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4405:65: 4405 | *t2869 - 0.6000000000e1_dp*t405*t2873*t237 | ^ Warning: ‘t406’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3112:26: 3112 | t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, t4201, & | ^ note: ‘t406’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3591:35: 3591 | *t49*t822*t14 | ^ Warning: ‘t405’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3112:20: 3112 | t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, t4201, & | ^ note: ‘t405’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4393:39: 4393 | *t400*t401*t2230 | ^ Warning: ‘t401’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3111:75: 3111 | t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, t4025, & | ^ note: ‘t401’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5221:38: 5221 | t5643 = t400*t3975*t561 | ^ Warning: ‘t400’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3111:69: 3111 | t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, t4025, & | ^ note: ‘t400’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4420:41: 4420 | t2992 = 0.1e1_dp/t1140/t40 | ^ Warning: ‘t40’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3111:63: 3111 | t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, t4025, & | ^ note: ‘t40’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3841:30: 3841 | t1409 = t4*t164 | ^ Warning: ‘t4’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3111:58: 3111 | t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, t4025, & | ^ note: ‘t4’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4099:32: 4099 | t1912 = t399*t245 | ^ Warning: ‘t399’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3111:54: 3111 | t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, t4025, & | ^ note: ‘t399’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4498:31: 4498 | t3278 = rho*t398 | ^ Warning: ‘t398’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3111:41: 3111 | t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, t4025, & | ^ note: ‘t398’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4366:104: 4366 | *t394) + 0.5000000001e0_dp*t165*t2720*t237 | ^ Warning: ‘t394’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3110:88: 3110 | REAL(kind=dp) :: t3871, t3875, t3892, t3918, t392, t3925, t393, t3933, t3939, t394, t3940, & | ^ note: ‘t394’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4823:58: 4823 | + 0.3333333334e0_dp*t165*t437*t1688 | ^ Warning: ‘t393’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3110:68: 3110 | REAL(kind=dp) :: t3871, t3875, t3892, t3918, t392, t3925, t393, t3933, t3939, t394, t3940, & | ^ note: ‘t393’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4418:57: 4418 | - 0.5000000001e0_dp*t429*t437*t914 | ^ Warning: ‘t392’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3110:55: 3110 | REAL(kind=dp) :: t3871, t3875, t3892, t3918, t392, t3925, t393, t3933, t3939, t394, t3940, & | ^ note: ‘t392’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3834:29: 3834 | *t1397 | ^ Warning: ‘t387’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3109:74: 3109 | t3827, t383, t384, t3842, t3849, t3853, t3861, t3865, t3869, t387 | ^ note: ‘t387’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4508:66: 4508 | *t1068 + 0.8333333340e-1_dp*t906*t384*t2160 | ^ Warning: ‘t384’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3109:26: 3109 | t3827, t383, t384, t3842, t3849, t3853, t3861, t3865, t3869, t387 | ^ note: ‘t384’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5099:51: 5099 | t5335 = 0.2222222224e0_dp*t383*t5281 | ^ Warning: ‘t383’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3109:20: 3109 | t3827, t383, t384, t3842, t3849, t3853, t3861, t3865, t3869, t387 | ^ note: ‘t383’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3834:29: 3834 | *t1397 | ^ Warning: ‘t380’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3108:90: 3108 | t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, t3826, & | ^ note: ‘t380’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4508:66: 4508 | *t1068 + 0.8333333340e-1_dp*t906*t384*t2160 | ^ Warning: ‘t379’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3108:70: 3108 | t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, t3826, & | ^ note: ‘t379’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5205:42: 5205 | t5602 = 0.40e1_dp*t624*t376 | ^ Warning: ‘t376’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3108:57: 3108 | t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, t3826, & | ^ note: ‘t376’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4340:55: 4340 | 0.5866666667e2_dp*t962*t949*t375 | ^ Warning: ‘t375’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3108:44: 3108 | t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, t3826, & | ^ note: ‘t375’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3972:48: 3972 | t1662 = 0.3200000000e2_dp*t7*t372 | ^ Warning: ‘t372’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3108:31: 3108 | t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, t3826, & | ^ note: ‘t372’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4322:34: 4322 | *t2565*t796 | ^ Warning: ‘t371’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3108:18: 3108 | t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, t3826, & | ^ note: ‘t371’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3490:61: 3490 | t561 = 0.40e1_dp*t24*t37 - 0.20e1_dp*t102*t558 | ^ Warning: ‘t37’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3108:12: 3108 | t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, t3826, & | ^ note: ‘t37’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4322:34: 4322 | *t2565*t796 | ^ Warning: ‘t368’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3107:86: 3107 | t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, t3682, & | ^ note: ‘t368’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3634:31: 3634 | t942 = t367*t306 | ^ Warning: ‘t367’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3107:52: 3107 | t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, t3682, & | ^ note: ‘t367’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5164:38: 5164 | t5496 = t366*t368*t1681 | ^ Warning: ‘t366’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3107:39: 3107 | t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, t3682, & | ^ note: ‘t366’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4322:34: 4322 | *t2565*t796 | ^ Warning: ‘t365’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3107:33: 3107 | t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, t3682, & | ^ note: ‘t365’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3973:42: 3973 | t1664 = 0.60e1_dp*t550*t362 | ^ Warning: ‘t362’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3107:27: 3107 | t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, t3682, & | ^ note: ‘t362’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4322:34: 4322 | *t2565*t796 | ^ Warning: ‘t360’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3106:93: 3106 | t3547, t3552, t3553, t356, t3561, t3569, t357, t3575, t3576, t3580, t3581, t36, t360, & | ^ note: ‘t360’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3331:30: 3331 | t221 = t220*t36 | ^ Warning: ‘t36’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3106:87: 3106 | t3547, t3552, t3553, t356, t3561, t3569, t357, t3575, t3576, t3580, t3581, t36, t360, & | ^ note: ‘t36’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4439:76: 4439 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 | ^ Warning: ‘t357’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3106:54: 3106 | t3547, t3552, t3553, t356, t3561, t3569, t357, t3575, t3576, t3580, t3581, t36, t360, & | ^ note: ‘t357’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3677:32: 3677 | t1002*rho | ^ Warning: ‘t356’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3106:34: 3106 | t3547, t3552, t3553, t356, t3561, t3569, t357, t3575, t3576, t3580, t3581, t36, t360, & | ^ note: ‘t356’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3969:51: 3969 | t1656 = 0.8000000000e1_dp*t1429*t352 | ^ Warning: ‘t352’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3105:66: 3105 | t35, t350, t3501, t3505, t3507, t3512, t3513, t3514, t352, t3525, t3533, t3543, t3546, & | ^ note: ‘t352’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: 4622 | *t786*t1034*t1681 | ^ Warning: ‘t350’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3105:18: 3105 | t35, t350, t3501, t3505, t3507, t3512, t3513, t3514, t352, t3525, t3533, t3543, t3546, & | ^ note: ‘t350’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4331:40: 4331 | t2585 = 0.1e1_dp/t972/t35 | ^ Warning: ‘t35’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3105:12: 3105 | t35, t350, t3501, t3505, t3507, t3512, t3513, t3514, t352, t3525, t3533, t3543, t3546, & | ^ note: ‘t35’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5159:51: 5159 | t5484 = 0.1760000000e3_dp*t5460*t347 | ^ Warning: ‘t347’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3104:65: 3104 | t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, t3497, & | ^ note: ‘t347’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3965:51: 3965 | t1647 = 0.5600000000e2_dp*t1645*t343 | ^ Warning: ‘t343’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3104:45: 3104 | t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, t3497, & | ^ note: ‘t343’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: 4613 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: ‘t342’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3104:39: 3104 | t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, t3497, & | ^ note: ‘t342’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4497:80: 4497 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 | ^ Warning: ‘t341’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3104:33: 3104 | t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, t3497, & | ^ note: ‘t341’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t339’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3104:27: 3104 | t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, t3497, & | ^ note: ‘t339’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3960:49: 3960 | t1638 = 0.1200000000e3_dp*t24*t336 | ^ Warning: ‘t336’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3103:69: 3103 | REAL(kind=dp) :: t3344, t3347, t3352, t3353, t3356, t3357, t336, t3362, t3363, t3366, t3378, & | ^ note: ‘t336’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3974:76: 3974 | t1667 = 0.28e2_dp/0.3e1_dp*t332 - 0.28e2_dp/0.3e1_dp*t987*rho | ^ Warning: ‘t332’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3102:67: 3102 | t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329, t3339 | ^ note: ‘t332’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4519:73: 4519 | e_rho_rho_rho_spin(ii) = e_rho_rho_rho_spin(ii) + t3291*sx | ^ Warning: ‘t3291’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3102:40: 3102 | t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329, t3339 | ^ note: ‘t3291’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3944:42: 3944 | t1615 = 0.80e1_dp*t112*t329 | ^ Warning: ‘t329’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3102:33: 3102 | t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329, t3339 | ^ note: ‘t329’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4340:55: 4340 | 0.5866666667e2_dp*t962*t949*t375 | ^ Warning: ‘t328’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3102:20: 3102 | t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329, t3339 | ^ note: ‘t328’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4653:32: 4653 | t3842 = t3278*t46 | ^ Warning: ‘t3278’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3102:14: 3102 | t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329, t3339 | ^ note: ‘t3278’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4330:85: 4330 | - 0.20e1_dp*t102*t105*t2569 - 0.6400000001e2_dp*t321*t953*t979 | ^ Warning: ‘t327’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:92: 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & | ^ note: ‘t327’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4704:32: 4704 | t4025 = t3262*t57 | ^ Warning: ‘t3262’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:72: 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & | ^ note: ‘t3262’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3933:31: 3933 | t1598 = t326*rho | ^ Warning: ‘t326’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:65: 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & | ^ note: ‘t326’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4833:71: 4833 | *t3507 - t3512)*t149*t160 | ^ Warning: ‘t3248’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:59: 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & | ^ note: ‘t3248’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4806:41: 4806 | *t1246*t3244*t1483 | ^ Warning: ‘t3244’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:52: 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & | ^ note: ‘t3244’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5192:51: 5192 | t5568 = 0.1066666667e2_dp*t1645*t322 | ^ Warning: ‘t322’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:38: 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & | ^ note: ‘t322’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5154:57: 5154 | t5472 = 0.3200000001e2_dp*t321*t2455*t5079 | ^ Warning: ‘t321’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:32: 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & | ^ note: ‘t321’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3931:43: 3931 | t1596 = 0.320e2_dp*t605*t318 | ^ Warning: ‘t318’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:19: 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & | ^ note: ‘t318’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4340:55: 4340 | 0.5866666667e2_dp*t962*t949*t375 | ^ Warning: ‘t317’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:13: 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & | ^ note: ‘t317’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4340:55: 4340 | 0.5866666667e2_dp*t962*t949*t375 | ^ Warning: ‘t316’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3100:97: 3100 | t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, t3141, t316, & | ^ note: ‘t316’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5149:51: 5149 | t5462 = 0.1173333333e3_dp*t5460*t313 | ^ Warning: ‘t313’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3100:84: 3100 | t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, t3141, t316, & | ^ note: ‘t313’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: ‘t311’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3100:71: 3100 | t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, t3141, t316, & | ^ note: ‘t311’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3487:29: 3487 | t551 = t27*t31 | ^ Warning: ‘t31’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3100:65: 3100 | t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, t3141, t316, & | ^ note: ‘t31’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4774:64: 4774 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 | ^ Warning: ‘t3097’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3100:53: 3100 | t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, t3141, t316, & | ^ note: ‘t3097’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3662:40: 3662 | t1002 = 0.1e1_dp/t19/t309 | ^ Warning: ‘t309’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3100:39: 3100 | t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, t3141, t316, & | ^ note: ‘t309’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3672:31: 3672 | t1033 = t308*t12 | ^ Warning: ‘t308’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3100:26: 3100 | t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, t3141, t316, & | ^ note: ‘t308’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5207:56: 5207 | t5607 = 0.5866666667e2_dp*t307*t949*t5069 | ^ Warning: ‘t307’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3100:13: 3100 | t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, t3141, t316, & | ^ note: ‘t307’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3630:31: 3630 | t929 = t306*t311 | ^ Warning: ‘t306’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:85: 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & | ^ note: ‘t306’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4737:39: 4737 | *t478*t183*t3918 | ^ Warning: ‘t3030’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:79: 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & | ^ note: ‘t3030’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t302’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:65: 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & | ^ note: ‘t302’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4737:39: 4737 | *t478*t183*t3918 | ^ Warning: ‘t2998’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:59: 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & | ^ note: ‘t2998’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4737:39: 4737 | *t478*t183*t3918 | ^ Warning: ‘t2994’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:52: 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & | ^ note: ‘t2994’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5550:29: 5550 | *t6271 | ^ Warning: ‘t2992’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:45: 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & | ^ note: ‘t2992’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3921:49: 3921 | t1579 = 0.1173333333e3_dp*t24*t299 | ^ Warning: ‘t299’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:38: 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & | ^ note: ‘t299’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3932:30: 3932 | t1597 = t7*t298 | ^ Warning: ‘t298’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:32: 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & | ^ note: ‘t298’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3834:29: 3834 | *t1397 | ^ Warning: ‘t295’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:26: 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & | ^ note: ‘t295’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4516:85: 4516 | + t3288) | ^ Warning: ‘t294’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:20: 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & | ^ note: ‘t294’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4823:58: 4823 | + 0.3333333334e0_dp*t165*t437*t1688 | ^ Warning: ‘t2937’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:14: 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & | ^ note: ‘t2937’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4508:66: 4508 | *t1068 + 0.8333333340e-1_dp*t906*t384*t2160 | ^ Warning: ‘t290’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3098:88: 3098 | t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, t2935, & | ^ note: ‘t290’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5428:38: 5428 | t6181 = t289*t1564*t593 | ^ Warning: ‘t289’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3098:82: 3098 | t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, t2935, & | ^ note: ‘t289’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5115:39: 5115 | t5373 = t2885*t446*t5371 | ^ Warning: ‘t2885’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3098:76: 3098 | t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, t2935, & | ^ note: ‘t2885’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4695:34: 4695 | t1320*t1483 | ^ Warning: ‘t2873’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3098:62: 3098 | t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, t2935, & | ^ note: ‘t2873’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3838:106: 3838 | t804 - 0.4444444448e0_dp*t43*t894 + t8*t1401)*sx | ^ Warning: ‘t283’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3098:27: 3098 | t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, t2935, & | ^ note: ‘t283’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4682:40: 4682 | *t400*t1333*t1410 | ^ Warning: ‘t2823’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3098:21: 3098 | t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, t2935, & | ^ note: ‘t2823’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5481:36: 5481 | t5011 + t5001 | ^ Warning: ‘t2821’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3098:14: 3098 | t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, t2935, & | ^ note: ‘t2821’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4516:85: 4516 | + t3288) | ^ Warning: ‘t282’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3097:94: 3097 | t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, t282, & | ^ note: ‘t282’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4682:40: 4682 | *t400*t1333*t1410 | ^ Warning: ‘t2808’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3097:81: 3097 | t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, t282, & | ^ note: ‘t2808’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4497:80: 4497 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 | ^ Warning: ‘t278’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3097:67: 3097 | t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, t282, & | ^ note: ‘t278’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5118:59: 5118 | t5383 = 0.4166666667e-1_dp*t2763*t1247*t5002 | ^ Warning: ‘t2763’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3097:54: 3097 | t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, t282, & | ^ note: ‘t2763’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4463:34: 4463 | *t503*t2312 | ^ Warning: ‘t275’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3097:40: 3097 | t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, t282, & | ^ note: ‘t275’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4580:33: 4580 | t3569 = t274*t1505 | ^ Warning: ‘t274’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3097:34: 3097 | t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, t282, & | ^ note: ‘t274’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4806:41: 4806 | *t1246*t3244*t1483 | ^ Warning: ‘t2720’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3097:14: 3097 | t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, t282, & | ^ note: ‘t2720’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4450:69: 4450 | *(t199)*(t2281) - 0.1851851853e0_dp*t508*t1201 | ^ Warning: ‘t271’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3096:91: 3096 | REAL(kind=dp) :: t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, t271, & | ^ note: ‘t271’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4842:60: 4842 | + 0.2500000000e0_dp*t1981*t2707*t1410 | ^ Warning: ‘t2707’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3096:85: 3096 | REAL(kind=dp) :: t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, t271, & | ^ note: ‘t2707’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3487:29: 3487 | t551 = t27*t31 | ^ Warning: ‘t27’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3096:78: 3096 | REAL(kind=dp) :: t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, t271, & | ^ note: ‘t27’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: ‘t268’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3096:73: 3096 | REAL(kind=dp) :: t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, t271, & | ^ note: ‘t268’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: ‘t267’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3096:67: 3096 | REAL(kind=dp) :: t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, t271, & | ^ note: ‘t267’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4450:69: 4450 | *(t199)*(t2281) - 0.1851851853e0_dp*t508*t1201 | ^ Warning: ‘t266’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3096:61: 3096 | REAL(kind=dp) :: t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, t271, & | ^ note: ‘t266’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4851:39: 4851 | *t289*t294*t1553 | ^ Warning: ‘t2636’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3096:35: 3096 | REAL(kind=dp) :: t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, t271, & | ^ note: ‘t2636’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4859:42: 4859 | *t83*t45*t3581*t140 | ^ Warning: ‘t2631’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3095:80: 3095 | t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622, t2631 | ^ note: ‘t2631’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4058:32: 4058 | t1821 = t472*t262 | ^ Warning: ‘t262’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3095:59: 3095 | t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622, t2631 | ^ note: ‘t262’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5143:57: 5143 | t5449 = 0.1173333333e3_dp*t307*t2611*t5065 | ^ Warning: ‘t2611’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3095:53: 3095 | t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622, t2631 | ^ note: ‘t2611’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5248:73: 5248 | t5716 = 0.1620000000e3_dp*t4994*t392*t4769*t1141*t26*t5713 | ^ Warning: ‘t26’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3095:40: 3095 | t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622, t2631 | ^ note: ‘t26’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4630:33: 4630 | t3750 = t2585*t136 | ^ Warning: ‘t2585’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3095:35: 3095 | t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622, t2631 | ^ note: ‘t2585’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5172:67: 5172 | *t5511 + 0.1200000000e3_dp*t1055*t2565*t4721 | ^ Warning: ‘t2565’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3095:14: 3095 | t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622, t2631 | ^ note: ‘t2565’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4604:32: 4604 | t3668 = t2552*t23 | ^ Warning: ‘t2552’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:93: 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & | ^ note: ‘t2552’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: 4613 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: ‘t2537’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:86: 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & | ^ note: ‘t2537’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5005:38: 5005 | + t5032 + t5035 | ^ Warning: ‘t250’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:79: 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & | ^ note: ‘t250’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3479:26: 3479 | t537 | ^ Warning: ‘t25’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:73: 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & | ^ note: ‘t25’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4927:59: 4927 | - 0.2400000000e2_dp*t786/t2492*t1058 | ^ Warning: ‘t2492’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:68: 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & | ^ note: ‘t2492’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4295:40: 4295 | *t1368*t166*t2160 | ^ Warning: ‘t249’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:61: 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & | ^ note: ‘t249’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5024:66: 5024 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 | ^ Warning: ‘t2480’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:55: 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & | ^ note: ‘t2480’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4629:39: 4629 | *t321*t953*t1625 | ^ Warning: ‘t2468’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:48: 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & | ^ note: ‘t2468’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5154:57: 5154 | t5472 = 0.3200000001e2_dp*t321*t2455*t5079 | ^ Warning: ‘t2455’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:41: 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & | ^ note: ‘t2455’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4099:32: 4099 | t1912 = t399*t245 | ^ Warning: ‘t245’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:27: 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & | ^ note: ‘t245’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4851:39: 4851 | *t289*t294*t1553 | ^ Warning: ‘t2404’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3093:79: 3093 | t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, t2424, & | ^ note: ‘t2404’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3387:30: 3387 | t350 = t24*t225 | ^ Warning: ‘t24’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3093:72: 3093 | t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, t2424, & | ^ note: ‘t24’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4516:85: 4516 | + t3288) | ^ Warning: ‘t237’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3093:46: 3093 | t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, t2424, & | ^ note: ‘t237’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3924:44: 3924 | t1584 = 0.320e2_dp*t1582*t234 | ^ Warning: ‘t234’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3093:26: 3093 | t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, t2424, & | ^ note: ‘t234’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4330:85: 4330 | - 0.20e1_dp*t102*t105*t2569 - 0.6400000001e2_dp*t321*t953*t979 | ^ Warning: ‘t233’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3093:20: 3093 | t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, t2424, & | ^ note: ‘t233’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3855:53: 3855 | + 0.8000000000e1_dp*t366*t1440 | ^ Warning: ‘t230’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3092:46: 3092 | t2292, t2295, t2296, t2299, t23, t230, t2300, t2304, t2307, t2308, t2311, t2312, t2319, & | ^ note: ‘t230’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3945:29: 3945 | t1616 = t7*t23 | ^ Warning: ‘t23’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3092:40: 3092 | t2292, t2295, t2296, t2299, t23, t230, t2300, t2304, t2307, t2308, t2311, t2312, t2319, & | ^ note: ‘t23’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4422:31: 4422 | t2998 = t27*t225 | ^ Warning: ‘t225’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3090:87: 3090 | t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, t2257, & | ^ note: ‘t225’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3659:40: 3659 | t995 = 0.1e1_dp/t787/t224 | ^ Warning: ‘t224’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3090:81: 3090 | t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, t2257, & | ^ note: ‘t224’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: 4622 | *t786*t1034*t1681 | ^ Warning: ‘t2220’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3090:54: 3090 | t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, t2257, & | ^ note: ‘t2220’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3859:28: 3859 | t1444 | ^ Warning: ‘t221’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3090:47: 3090 | t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, t2257, & | ^ note: ‘t221’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4322:34: 4322 | *t2565*t796 | ^ Warning: ‘t220’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3090:13: 3090 | t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, t2257, & | ^ note: ‘t220’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3377:30: 3377 | t327 = t22*t326 | ^ Warning: ‘t22’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3089:93: 3089 | REAL(kind=dp) :: t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, t22, & | ^ note: ‘t22’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3657:31: 3657 | t987 = t219*t341 | ^ Warning: ‘t219’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3089:60: 3089 | REAL(kind=dp) :: t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, t22, & | ^ note: ‘t219’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5024:66: 5024 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 | ^ Warning: ‘t2182’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3089:40: 3089 | REAL(kind=dp) :: t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, t22, & | ^ note: ‘t2182’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4322:34: 4322 | *t2565*t796 | ^ Warning: ‘t218’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3089:33: 3089 | REAL(kind=dp) :: t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, t22, & | ^ note: ‘t218’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4936:42: 4936 | t4864 = t217*t46*t1535*t561 | ^ Warning: ‘t217’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3089:27: 3089 | REAL(kind=dp) :: t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, t22, & | ^ note: ‘t217’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4873:56: 4873 | t4704 = 0.3333333336e0_dp*t2147*t84*t4701 | ^ Warning: ‘t2147’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3088:55: 3088 | t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160, t2169 | ^ note: ‘t2147’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4908:55: 4908 | t4789 = 0.4444444448e0_dp*t214*t46*t4786 | ^ Warning: ‘t214’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3088:41: 3088 | t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160, t2169 | ^ note: ‘t214’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5510:79: 5510 | *t6181 - t6185 + t6189 - t6192 - 0.3333333336e0_dp*t6194 | ^ Warning: ‘t2139’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3088:35: 3088 | t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160, t2169 | ^ note: ‘t2139’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5525:90: 5525 | t5418 + 0.1800000000e2_dp*t658*t575*t2074 + 0.1800000000e2_dp*t5421 | ^ Warning: ‘t2131’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3088:21: 3088 | t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160, t2169 | ^ note: ‘t2131’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5562:82: 5562 | *t719*t2126 - t5973 + t5975 + 0.5999999999e1_dp*t2114*t6257 | ^ Warning: ‘t2126’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:91: 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & | ^ note: ‘t2126’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5582:46: 5582 | *t60*t2124*t709 - t6044 | ^ Warning: ‘t2124’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:84: 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & | ^ note: ‘t2124’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5562:82: 5562 | *t719*t2126 - t5973 + t5975 + 0.5999999999e1_dp*t2114*t6257 | ^ Warning: ‘t2118’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:77: 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & | ^ note: ‘t2118’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5566:41: 5566 | *t5228*t2117*t2028 | ^ Warning: ‘t2117’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:70: 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & | ^ note: ‘t2117’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5562:82: 5562 | *t719*t2126 - t5973 + t5975 + 0.5999999999e1_dp*t2114*t6257 | ^ Warning: ‘t2114’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:63: 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & | ^ note: ‘t2114’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5582:46: 5582 | *t60*t2124*t709 - t6044 | ^ Warning: ‘t2113’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:56: 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & | ^ note: ‘t2113’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5572:60: 5572 | t6260 + 0.8999999998e1_dp*t5229*t2104 | ^ Warning: ‘t2104’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:42: 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & | ^ note: ‘t2104’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5550:29: 5550 | *t6271 | ^ Warning: ‘t2099’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:35: 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & | ^ note: ‘t2099’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5566:41: 5566 | *t5228*t2117*t2028 | ^ Warning: ‘t2098’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:28: 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & | ^ note: ‘t2098’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5562:82: 5562 | *t719*t2126 - t5973 + t5975 + 0.5999999999e1_dp*t2114*t6257 | ^ Warning: ‘t2095’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:21: 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & | ^ note: ‘t2095’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5592:76: 5592 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) | ^ Warning: ‘t2088’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:14: 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & | ^ note: ‘t2088’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5592:76: 5592 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) | ^ Warning: ‘t2082’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:90: 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & | ^ note: ‘t2082’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5540:38: 5540 | - t6090 + t6094 | ^ Warning: ‘t2081’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:83: 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & | ^ note: ‘t2081’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5592:76: 5592 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) | ^ Warning: ‘t2077’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:76: 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & | ^ note: ‘t2077’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5525:90: 5525 | t5418 + 0.1800000000e2_dp*t658*t575*t2074 + 0.1800000000e2_dp*t5421 | ^ Warning: ‘t2074’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:69: 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & | ^ note: ‘t2074’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4651:71: 4651 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 | ^ Warning: ‘t207’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:55: 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & | ^ note: ‘t207’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5511:33: 5511 | t6400 = t2061*t561 | ^ Warning: ‘t2061’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:49: 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & | ^ note: ‘t2061’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5503:78: 5503 | - t5595 + t5597 - t5600 - t5602 + t5604 + t5607 + t5610 | ^ Warning: ‘t2058’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:42: 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & | ^ note: ‘t2058’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5493:79: 5493 | *t327*t2057*t557 - t5456 + t5459 - t5462 + t5466 - t5468 | ^ Warning: ‘t2057’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:35: 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & | ^ note: ‘t2057’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5497:40: 5497 | *t1054*t640*t3679 | ^ Warning: ‘t2054’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:28: 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & | ^ note: ‘t2054’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5597:132: 5597 | + t6442 + t6451 + t6461 + t6479 + t6490 + t6499 + t6658) | ^ Warning: ‘t2050’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:21: 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & | ^ note: ‘t2050’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5601:73: 5601 | t43*t46*t6339 + t8*(t6344 + t6380 + t6389 + t6665) | ^ Warning: ‘t2046’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:14: 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & | ^ note: ‘t2046’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5536:63: 5536 | *t575*t161*t1447 + t5773 + t5776 + t5780 | ^ Warning: ‘t2042’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:97: 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & | ^ note: ‘t2042’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5592:76: 5592 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) | ^ Warning: ‘t2035’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:90: 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & | ^ note: ‘t2035’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5582:46: 5582 | *t60*t2124*t709 - t6044 | ^ Warning: ‘t2032’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:83: 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & | ^ note: ‘t2032’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5515:46: 5515 | *t27*t6291*t172 - t5397 | ^ Warning: ‘t2031’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:76: 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & | ^ note: ‘t2031’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3438:30: 3438 | t466 = t27*t203 | ^ Warning: ‘t203’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:69: 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & | ^ note: ‘t203’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5566:41: 5566 | *t5228*t2117*t2028 | ^ Warning: ‘t2028’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:63: 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & | ^ note: ‘t2028’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5550:29: 5550 | *t6271 | ^ Warning: ‘t2027’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:56: 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & | ^ note: ‘t2027’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5005:38: 5005 | + t5032 + t5035 | ^ Warning: ‘t2022’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:49: 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & | ^ note: ‘t2022’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5488:54: 5488 | + 0.4500000000e1_dp*t2009*t4744 | ^ Warning: ‘t2018’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:42: 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & | ^ note: ‘t2018’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5488:54: 5488 | + 0.4500000000e1_dp*t2009*t4744 | ^ Warning: ‘t2014’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:35: 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & | ^ note: ‘t2014’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5488:54: 5488 | + 0.4500000000e1_dp*t2009*t4744 | ^ Warning: ‘t2013’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:28: 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & | ^ note: ‘t2013’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5488:54: 5488 | + 0.4500000000e1_dp*t2009*t4744 | ^ Warning: ‘t2009’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:21: 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & | ^ note: ‘t2009’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4667:32: 4667 | t3875 = t45*t2002 | ^ Warning: ‘t2002’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3084:94: 3084 | t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, t2002, & | ^ note: ‘t2002’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3549:87: 3549 | t200 - 0.5555555558e-1_dp*t192*t729 - 0.5000000001e0_dp*t732*t709 | ^ Warning: ‘t200’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3084:73: 3084 | t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, t2002, & | ^ note: ‘t200’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4127:31: 4127 | t1972 = t177*t20 | ^ Warning: ‘t20’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3084:67: 3084 | t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, t2002, & | ^ note: ‘t20’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3465:31: 3465 | t534 = t199*t267 | ^ Warning: ‘t199’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3084:41: 3084 | t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, t2002, & | ^ note: ‘t199’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5250:56: 5250 | t5722 = 0.1111111111e0_dp*t165*t689*t1988 | ^ Warning: ‘t1988’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3084:35: 3084 | t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, t2002, & | ^ note: ‘t1988’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4798:66: 4798 | *t1410 - 0.1666666667e0_dp*t429*t1392*t1410 | ^ Warning: ‘t1981’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3084:14: 3084 | t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, t2002, & | ^ note: ‘t1981’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5129:43: 5129 | t5421 = t657*t1884*t59*t1975 | ^ Warning: ‘t1975’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3083:83: 3083 | t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, t1980, & | ^ note: ‘t1975’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5528:70: 5528 | + t5619 + t5622 - t5625 - t5628 + t5631 + t5716 | ^ Warning: ‘t1974’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3083:76: 3083 | t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, t1980, & | ^ note: ‘t1974’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5488:54: 5488 | + 0.4500000000e1_dp*t2009*t4744 | ^ Warning: ‘t1973’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3083:69: 3083 | t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, t1980, & | ^ note: ‘t1973’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5403:63: 5403 | t6106 = 0.3600000000e2_dp*t1971*t1972*t1973*t672 | ^ Warning: ‘t1972’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3083:62: 3083 | t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, t1980, & | ^ note: ‘t1972’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5403:63: 5403 | t6106 = 0.3600000000e2_dp*t1971*t1972*t1973*t672 | ^ Warning: ‘t1971’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3083:55: 3083 | t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, t1980, & | ^ note: ‘t1971’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5393:57: 5393 | t6087 = 0.1666666667e0_dp*t429*t1966*t1410 | ^ Warning: ‘t1966’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3083:41: 3083 | t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, t1980, & | ^ note: ‘t1966’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5077:68: 5077 | *t462*t4729 + 0.3333333334e0_dp*t55*t57*t5276 | ^ Warning: ‘t1962’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3083:27: 3083 | t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, t1980, & | ^ note: ‘t1962’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3549:87: 3549 | t200 - 0.5555555558e-1_dp*t192*t729 - 0.5000000001e0_dp*t732*t709 | ^ Warning: ‘t196’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3083:13: 3083 | t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, t1980, & | ^ note: ‘t196’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3460:30: 3460 | t520 = t195*t25 | ^ Warning: ‘t195’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3082:75: 3082 | REAL(kind=dp) :: t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, t1958, & | ^ note: ‘t195’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4814:44: 4814 | + (2*t147*t1284*t672) | ^ Warning: ‘t1940’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3082:55: 3082 | REAL(kind=dp) :: t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, t1958, & | ^ note: ‘t1940’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3462:36: 3462 | t527 = t194*t187*t526 | ^ Warning: ‘t194’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3082:48: 3082 | REAL(kind=dp) :: t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, t1958, & | ^ note: ‘t194’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4806:41: 4806 | *t1246*t3244*t1483 | ^ Warning: ‘t1932’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3082:28: 3082 | REAL(kind=dp) :: t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, t1958, & | ^ note: ‘t1932’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5413:38: 5413 | t6138 = t429*t1928*t593 | ^ Warning: ‘t1928’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3081:62: 3081 | t1914, t1917, t192, t1920, t1923, t1924, t1925, t1928 | ^ note: ‘t1928’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5414:38: 5414 | t6141 = t658*t575*t1925 | ^ Warning: ‘t1925’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3081:55: 3081 | t1914, t1917, t192, t1920, t1923, t1924, t1925, t1928 | ^ note: ‘t1925’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4823:58: 4823 | + 0.3333333334e0_dp*t165*t437*t1688 | ^ Warning: ‘t1924’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3081:48: 3081 | t1914, t1917, t192, t1920, t1923, t1924, t1925, t1928 | ^ note: ‘t1924’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5328:38: 5328 | t5938 = t192*t728*t1505 | ^ Warning: ‘t192’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3081:27: 3081 | t1914, t1917, t192, t1920, t1923, t1924, t1925, t1928 | ^ note: ‘t192’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4695:34: 4695 | t1320*t1483 | ^ Warning: ‘t1912’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3080:95: 3080 | t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, t1912, & | ^ note: ‘t1912’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4695:34: 4695 | t1320*t1483 | ^ Warning: ‘t1902’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3080:74: 3080 | t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, t1912, & | ^ note: ‘t1902’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5488:54: 5488 | + 0.4500000000e1_dp*t2009*t4744 | ^ Warning: ‘t19’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3080:60: 3080 | t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, t1912, & | ^ note: ‘t19’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5228:58: 5228 | t5666 = 0.1125000000e2_dp*t1302*t1892*t1410 | ^ Warning: ‘t1892’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3080:41: 3080 | t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, t1912, & | ^ note: ‘t1892’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3453:30: 3453 | t503 = t189*t67 | ^ Warning: ‘t189’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3080:27: 3080 | t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, t1912, & | ^ note: ‘t189’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4814:44: 4814 | + (2*t147*t1284*t672) | ^ Warning: ‘t1886’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3080:21: 3080 | t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, t1912, & | ^ note: ‘t1886’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5481:36: 5481 | t5011 + t5001 | ^ Warning: ‘t1885’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3080:14: 3080 | t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, t1912, & | ^ note: ‘t1885’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5129:43: 5129 | t5421 = t657*t1884*t59*t1975 | ^ Warning: ‘t1884’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3079:97: 3079 | t1854, t1858, t1861, t1864, t1865, t1868, t187, t1871, t1874, t1875, t1878, t1881, t1884, & | ^ note: ‘t1884’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4842:60: 4842 | + 0.2500000000e0_dp*t1981*t2707*t1410 | ^ Warning: ‘t1875’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3079:76: 3079 | t1854, t1858, t1861, t1864, t1865, t1868, t187, t1871, t1874, t1875, t1878, t1881, t1884, & | ^ note: ‘t1875’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3534:30: 3534 | t707 = t187*t59 | ^ Warning: ‘t187’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3079:55: 3079 | t1854, t1858, t1861, t1864, t1865, t1868, t187, t1871, t1874, t1875, t1878, t1881, t1884, & | ^ note: ‘t187’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5404:58: 5404 | t6109 = 0.1666666667e0_dp*t1246*t1962*t1865 | ^ Warning: ‘t1865’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3079:42: 3079 | t1854, t1858, t1861, t1864, t1865, t1868, t187, t1871, t1874, t1875, t1878, t1881, t1884, & | ^ note: ‘t1865’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4807:32: 4807 | t4498 = t56*t1843 | ^ Warning: ‘t1843’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3078:83: 3078 | t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, t1852, & | ^ note: ‘t1843’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5357:33: 5357 | t6006 = t719*t1838 | ^ Warning: ‘t1838’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3078:69: 3078 | t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, t1852, & | ^ note: ‘t1838’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4719:70: 4719 | *t508*t1769 - 0.1111111112e0_dp*t192*t1837*t267 | ^ Warning: ‘t1837’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3078:62: 3078 | t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, t1852, & | ^ note: ‘t1837’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5314:42: 5314 | t5908 = t1836*t59*t177*t710 | ^ Warning: ‘t1836’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3078:55: 3078 | t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, t1852, & | ^ note: ‘t1836’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4439:76: 4439 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 | ^ Warning: ‘t183’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3078:34: 3078 | t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, t1852, & | ^ note: ‘t183’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5276:40: 5276 | t5797 = t1373*t1962*t1829 | ^ Warning: ‘t1829’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3078:28: 3078 | t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, t1852, & | ^ note: ‘t1829’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5122:57: 5122 | t5400 = 0.3333333334e0_dp*t445*t1962*t1825 | ^ Warning: ‘t1825’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3078:14: 3078 | t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, t1852, & | ^ note: ‘t1825’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4747:29: 4747 | *t3382 | ^ Warning: ‘t1821’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3077:81: 3077 | t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, t1824, & | ^ note: ‘t1821’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4439:76: 4439 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 | ^ Warning: ‘t182’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3077:74: 3077 | t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, t1824, & | ^ note: ‘t182’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4737:39: 4737 | *t478*t183*t3918 | ^ Warning: ‘t1811’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3077:54: 3077 | t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, t1824, & | ^ note: ‘t1811’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5280:58: 5280 | t5810 = 0.1080000000e3_dp*t1143*t1801*t1410 | ^ Warning: ‘t1801’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3077:26: 3077 | t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, t1824, & | ^ note: ‘t1801’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5481:36: 5481 | t5011 + t5001 | ^ Warning: ‘t18’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3077:12: 3077 | t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, t1824, & | ^ note: ‘t18’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5332:52: 5332 | t5949 = 0.8999999998e1_dp*t1795*t4909 | ^ Warning: ‘t1795’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3076:90: 3076 | t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, t1797, & | ^ note: ‘t1795’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5340:34: 5340 | t5966 = t1785*t1790 | ^ Warning: ‘t1790’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3076:76: 3076 | t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, t1797, & | ^ note: ‘t1790’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5340:34: 5340 | t5966 = t1785*t1790 | ^ Warning: ‘t1785’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3076:55: 3076 | t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, t1797, & | ^ note: ‘t1785’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5387:51: 5387 | t6078 = 0.1111111112e0_dp*t719*t1782 | ^ Warning: ‘t1782’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3076:41: 3076 | t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, t1797, & | ^ note: ‘t1782’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5356:38: 5356 | t6004 = t1709*t178*t710 | ^ Warning: ‘t178’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3076:34: 3076 | t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, t1797, & | ^ note: ‘t178’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5358:52: 5358 | t6009 = 0.5000000001e0_dp*t1777*t4908 | ^ Warning: ‘t1777’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3076:21: 3076 | t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, t1797, & | ^ note: ‘t1777’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5350:52: 5350 | t5985 = 0.5000000001e0_dp*t1774*t4908 | ^ Warning: ‘t1774’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3075:96: 3075 | REAL(kind=dp) :: t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, t1774, & | ^ note: ‘t1774’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3535:31: 3535 | t708 = t707*t177 | ^ Warning: ‘t177’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3075:82: 3075 | REAL(kind=dp) :: t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, t1774, & | ^ note: ‘t177’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5308:33: 5308 | t5885 = t719*t1769 | ^ Warning: ‘t1769’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3075:76: 3075 | REAL(kind=dp) :: t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, t1774, & | ^ note: ‘t1769’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5382:40: 5382 | t6060 = t1766*t5881*t4940 | ^ Warning: ‘t1766’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3075:62: 3075 | REAL(kind=dp) :: t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, t1774, & | ^ note: ‘t1766’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5375:52: 5375 | t6044 = 0.2000000002e1_dp*t1763*t5956 | ^ Warning: ‘t1763’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3075:48: 3075 | REAL(kind=dp) :: t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, t1774, & | ^ note: ‘t1763’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3722:30: 3722 | t1140 = t176**2 | ^ Warning: ‘t176’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3075:27: 3075 | REAL(kind=dp) :: t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, t1774, & | ^ note: ‘t176’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4774:64: 4774 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 | ^ Warning: ‘t1755’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3074:56: 3074 | t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757, t1758 | ^ note: ‘t1755’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5369:72: 5369 | *t6021 + t6025 - 0.5555555558e-1_dp*t58*t5613*t71 | ^ Warning: ‘t1748’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3074:35: 3074 | t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757, t1758 | ^ note: ‘t1748’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4782:66: 4782 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 | ^ Warning: ‘t1745’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3074:28: 3074 | t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757, t1758 | ^ note: ‘t1745’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5334:52: 5334 | t5954 = 0.8999999998e1_dp*t1741*t4909 | ^ Warning: ‘t1741’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3074:14: 3074 | t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757, t1758 | ^ note: ‘t1741’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5326:57: 5326 | t5929 = 0.2250000000e2_dp*t1740*t471*t4905 | ^ Warning: ‘t1740’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3073:97: 3073 | t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, t1737, t1740, & | ^ note: ‘t1740’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4768:67: 4768 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 | ^ Warning: ‘t1737’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3073:90: 3073 | t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, t1737, t1740, & | ^ note: ‘t1737’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4775:32: 4775 | t4352 = t1731*t67 | ^ Warning: ‘t1731’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3073:76: 3073 | t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, t1737, t1740, & | ^ note: ‘t1731’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5360:52: 5360 | t6019 = 0.7407407410e-1_dp*t719*t1726 | ^ Warning: ‘t1726’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3073:55: 3073 | t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, t1737, t1740, & | ^ note: ‘t1726’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5392:37: 5392 | *t6075 - t6078 | ^ Warning: ‘t1722’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3073:41: 3073 | t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, t1737, t1740, & | ^ note: ‘t1722’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5383:52: 5383 | t6063 = 0.1000000000e1_dp*t1720*t5956 | ^ Warning: ‘t1720’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3073:34: 3073 | t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, t1737, t1740, & | ^ note: ‘t1720’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3554:70: 3554 | *t165*t462*t561 + 0.3333333334e0_dp*t55*t57*t735 | ^ Warning: ‘t172’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3073:27: 3073 | t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, t1737, t1740, & | ^ note: ‘t172’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5312:56: 5312 | t5902 = 0.1800000000e2_dp*t1718*t178*t710 | ^ Warning: ‘t1718’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3073:14: 3073 | t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, t1737, t1740, & | ^ note: ‘t1718’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5339:34: 5339 | t5964 = t1715*t1525 | ^ Warning: ‘t1715’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3072:89: 3072 | t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, t1715, t1717, & | ^ note: ‘t1715’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4768:67: 4768 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 | ^ Warning: ‘t1712’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3072:75: 3072 | t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, t1715, t1717, & | ^ note: ‘t1712’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3479:26: 3479 | t537 | ^ Warning: ‘t171’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3072:68: 3072 | t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, t1715, t1717, & | ^ note: ‘t171’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5356:38: 5356 | t6004 = t1709*t178*t710 | ^ Warning: ‘t1709’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3072:62: 3072 | t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, t1715, t1717, & | ^ note: ‘t1709’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4859:42: 4859 | *t83*t45*t3581*t140 | ^ Warning: ‘t1706’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3072:48: 3072 | t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, t1715, t1717, & | ^ note: ‘t1706’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4665:39: 4665 | *t165*t3865*t237 | ^ Warning: ‘t1703’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3072:34: 3072 | t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, t1715, t1717, & | ^ note: ‘t1703’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4651:71: 4651 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 | ^ Warning: ‘t1700’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3072:20: 3072 | t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, t1715, t1717, & | ^ note: ‘t1700’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5255:61: 5255 | t5738 = 0.4444444445e0_dp*t170*t114*t4782*t451 | ^ Warning: ‘t170’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3072:13: 3072 | t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, t1715, t1717, & | ^ note: ‘t170’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3479:26: 3479 | t537 | ^ Warning: ‘t17’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:96: 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & | ^ note: ‘t17’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4859:42: 4859 | *t83*t45*t3581*t140 | ^ Warning: ‘t1694’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:77: 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & | ^ note: ‘t1694’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4651:71: 4651 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 | ^ Warning: ‘t1689’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:63: 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & | ^ note: ‘t1689’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5426:37: 5426 | t6175 = t83*t597*t1688 | ^ Warning: ‘t1688’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:56: 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & | ^ note: ‘t1688’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5191:33: 5191 | t5565 = t112*t1685 | ^ Warning: ‘t1685’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:49: 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & | ^ note: ‘t1685’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5175:43: 5175 | t5528 = t102*t327*t1684*t557 | ^ Warning: ‘t1684’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:42: 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & | ^ note: ‘t1684’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5164:38: 5164 | t5496 = t366*t368*t1681 | ^ Warning: ‘t1681’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:35: 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & | ^ note: ‘t1681’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5169:38: 5169 | t5511 = t1680*t3673*t23 | ^ Warning: ‘t1680’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:28: 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & | ^ note: ‘t1680’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5163:49: 5163 | t5494 = 0.6400000000e2_dp*t7*t1677 | ^ Warning: ‘t1677’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:14: 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & | ^ note: ‘t1677’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5165:44: 5165 | t5499 = 0.120e2_dp*t550*t1669 | ^ Warning: ‘t1669’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3070:82: 3070 | t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, t1675, & | ^ note: ‘t1669’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5167:52: 5167 | t5507 = 0.120e2_dp*t7*t640*t1667*t371 | ^ Warning: ‘t1667’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3070:75: 3070 | t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, t1675, & | ^ note: ‘t1667’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3479:26: 3479 | t537 | ^ Warning: ‘t166’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3070:47: 3070 | t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, t1675, & | ^ note: ‘t166’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5161:52: 5161 | t5489 = 0.1600000000e2_dp*t1429*t1658 | ^ Warning: ‘t1658’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3070:41: 3070 | t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, t1675, & | ^ note: ‘t1658’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5160:54: 5160 | t5487 = 0.2160000000e3_dp*t7*t995*t1652 | ^ Warning: ‘t1652’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3070:20: 3070 | t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, t1675, & | ^ note: ‘t1652’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5271:57: 5271 | t5783 = 0.5555555557e-1_dp*t165*t5013*t433 | ^ Warning: ‘t165’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3070:13: 3070 | t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, t1675, & | ^ note: ‘t165’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4933:56: 4933 | t102*t4838 - 0.20e1_dp*t102*t4850 | ^ Warning: ‘t1645’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3069:83: 3069 | t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, t1649, & | ^ note: ‘t1645’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5158:49: 5158 | t5482 = 0.2160000000e3_dp*t7*t1642 | ^ Warning: ‘t1642’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3069:69: 3069 | t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, t1649, & | ^ note: ‘t1642’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5024:66: 5024 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 | ^ Warning: ‘t1640’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3069:62: 3069 | t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, t1649, & | ^ note: ‘t1640’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3432:31: 3432 | t445 = t164*t444 | ^ Warning: ‘t164’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3069:55: 3069 | t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, t1649, & | ^ note: ‘t164’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5177:44: 5177 | t5533 = 0.160e2_dp*t112*t1632 | ^ Warning: ‘t1632’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3069:28: 3069 | t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, t1649, & | ^ note: ‘t1632’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t1631’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3069:21: 3069 | t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, t1649, & | ^ note: ‘t1631’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5176:44: 5176 | t5531 = 0.160e2_dp*t112*t1626 | ^ Warning: ‘t1626’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3068:84: 3068 | REAL(kind=dp) :: t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, t1628, & | ^ note: ‘t1626’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4629:39: 4629 | *t321*t953*t1625 | ^ Warning: ‘t1625’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3068:77: 3068 | REAL(kind=dp) :: t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, t1628, & | ^ note: ‘t1625’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5179:44: 5179 | t5537 = 0.160e2_dp*t112*t1622 | ^ Warning: ‘t1622’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3068:63: 3068 | REAL(kind=dp) :: t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, t1628, & | ^ note: ‘t1622’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4629:39: 4629 | *t321*t953*t1625 | ^ Warning: ‘t1621’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3068:56: 3068 | REAL(kind=dp) :: t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, t1628, & | ^ note: ‘t1621’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5142:47: 5142 | t5446 = 0.480e2_dp*t24*t23*t1618 | ^ Warning: ‘t1618’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3068:42: 3068 | REAL(kind=dp) :: t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, t1628, & | ^ note: ‘t1618’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4629:39: 4629 | *t321*t953*t1625 | ^ Warning: ‘t1617’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3068:35: 3068 | REAL(kind=dp) :: t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, t1628, & | ^ note: ‘t1617’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4637:33: 4637 | *t339*t969 | ^ Warning: ‘t1616’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3068:28: 3068 | REAL(kind=dp) :: t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, t1628, & | ^ note: ‘t1616’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5174:51: 5174 | t5525 = 0.2133333334e2_dp*t339*t1611 | ^ Warning: ‘t1611’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3067:62: 3067 | t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613, t1615 | ^ note: ‘t1611’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4213:46: 4213 | - t1994 + t1997 - t2000 | ^ Warning: ‘t161’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3067:48: 3067 | t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613, t1615 | ^ note: ‘t161’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5155:51: 5155 | t5474 = 0.4266666668e2_dp*t339*t1608 | ^ Warning: ‘t1608’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3067:42: 3067 | t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613, t1615 | ^ note: ‘t1608’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5144:44: 5144 | t5451 = 0.640e2_dp*t605*t1603 | ^ Warning: ‘t1603’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3067:21: 3067 | t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613, t1615 | ^ note: ‘t1603’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4603:29: 4603 | *t3339 | ^ Warning: ‘t1602’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3067:14: 3067 | t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613, t1615 | ^ note: ‘t1602’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3413:31: 3413 | t394 = t393*t160 | ^ Warning: ‘t160’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3066:88: 3066 | t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, t1601, & | ^ note: ‘t160’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3852:46: 3852 | t1439 = 0.1e1_dp/t787/t16*t1438 | ^ Warning: ‘t16’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3066:82: 3066 | t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, t1601, & | ^ note: ‘t16’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5185:49: 5185 | t5551 = 0.1280e3_dp*t24*t298*t1599 | ^ Warning: ‘t1599’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3066:77: 3066 | t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, t1601, & | ^ note: ‘t1599’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t1598’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3066:70: 3066 | t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, t1601, & | ^ note: ‘t1598’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t1597’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3066:63: 3066 | t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, t1601, & | ^ note: ‘t1597’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5188:52: 5188 | t5560 = 0.2346666666e3_dp*t1589*t1592 | ^ Warning: ‘t1592’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3066:42: 3066 | t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, t1601, & | ^ note: ‘t1592’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4637:33: 4637 | *t339*t969 | ^ Warning: ‘t1589’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3066:28: 3066 | t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, t1601, & | ^ note: ‘t1589’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5146:46: 5146 | t5456 = 0.1280e3_dp*t1582*t1426 | ^ Warning: ‘t1582’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3065:84: 3065 | t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, t1584, & | ^ note: ‘t1582’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4859:42: 4859 | *t83*t45*t3581*t140 | ^ Warning: ‘t1575’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3065:56: 3065 | t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, t1584, & | ^ note: ‘t1575’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5424:56: 5424 | t6170 = 0.3333333336e0_dp*t289*t597*t1571 | ^ Warning: ‘t1571’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3065:42: 3065 | t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, t1584, & | ^ note: ‘t1571’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4665:39: 4665 | *t165*t3865*t237 | ^ Warning: ‘t1568’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3065:28: 3065 | t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, t1584, & | ^ note: ‘t1568’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4665:39: 4665 | *t165*t3865*t237 | ^ Warning: ‘t1565’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3065:21: 3065 | t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, t1584, & | ^ note: ‘t1565’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5428:38: 5428 | t6181 = t289*t1564*t593 | ^ Warning: ‘t1564’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3065:14: 3065 | t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, t1584, & | ^ note: ‘t1564’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4405:65: 4405 | *t2869 - 0.6000000000e1_dp*t405*t2873*t237 | ^ Warning: ‘t156’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3064:82: 3064 | t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, t1563, & | ^ note: ‘t156’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5438:56: 5438 | t6201 = 0.3333333336e0_dp*t289*t597*t1557 | ^ Warning: ‘t1557’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3064:76: 3064 | t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, t1563, & | ^ note: ‘t1557’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5429:56: 5429 | t6185 = 0.3333333336e0_dp*t289*t597*t1553 | ^ Warning: ‘t1553’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3064:62: 3064 | t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, t1563, & | ^ note: ‘t1553’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4393:39: 4393 | *t400*t401*t2230 | ^ Warning: ‘t155’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3064:48: 3064 | t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, t1563, & | ^ note: ‘t155’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4651:71: 4651 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 | ^ Warning: ‘t1547’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3064:35: 3064 | t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, t1563, & | ^ note: ‘t1547’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4851:39: 4851 | *t289*t294*t1553 | ^ Warning: ‘t1546’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3064:28: 3064 | t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, t1563, & | ^ note: ‘t1546’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4870:96: 4870 | t3869 + t4657 + t4696) | ^ Warning: ‘t1536’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3063:84: 3063 | t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, t1541, & | ^ note: ‘t1536’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4936:42: 4936 | t4864 = t217*t46*t1535*t561 | ^ Warning: ‘t1535’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3063:77: 3063 | t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, t1541, & | ^ note: ‘t1535’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4842:60: 4842 | + 0.2500000000e0_dp*t1981*t2707*t1410 | ^ Warning: ‘t1531’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3063:70: 3063 | t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, t1541, & | ^ note: ‘t1531’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4964:52: 4964 | t4932 = 0.5000000001e0_dp*t1528*t4908 | ^ Warning: ‘t1528’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3063:56: 3063 | t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, t1541, & | ^ note: ‘t1528’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4972:33: 4972 | t4952 = t719*t1525 | ^ Warning: ‘t1525’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3063:49: 3063 | t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, t1541, & | ^ note: ‘t1525’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5384:42: 5384 | t6066 = t1519*t705*t561*t65 | ^ Warning: ‘t1519’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3063:35: 3063 | t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, t1541, & | ^ note: ‘t1519’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5361:39: 5361 | t6021 = t649*t1518*t1722 | ^ Warning: ‘t1518’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3063:28: 3063 | t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, t1541, & | ^ note: ‘t1518’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4962:52: 4962 | t4925 = 0.5000000001e0_dp*t1513*t4908 | ^ Warning: ‘t1513’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:94: 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & | ^ note: ‘t1513’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4755:41: 4755 | t192*t68*t4256*t65 | ^ Warning: ‘t1510’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:80: 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & | ^ note: ‘t1510’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4167:80: 4167 | + t1482 + t1479 - t1489 + 0.3333333334e0_dp*t55*t57*t2042 | ^ Warning: ‘t151’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:73: 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & | ^ note: ‘t151’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4956:52: 4956 | t4911 = 0.8999999998e1_dp*t1507*t4909 | ^ Warning: ‘t1507’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:60: 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & | ^ note: ‘t1507’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4953:57: 4953 | t4907 = 0.2250000000e2_dp*t1506*t471*t4905 | ^ Warning: ‘t1506’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:53: 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & | ^ note: ‘t1506’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5328:38: 5328 | t5938 = t192*t728*t1505 | ^ Warning: ‘t1505’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:46: 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & | ^ note: ‘t1505’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5378:37: 5378 | t6052 = t1504*t561*t65 | ^ Warning: ‘t1504’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:39: 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & | ^ note: ‘t1504’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4946:39: 4946 | t4895 = t478*t1500*t4729 | ^ Warning: ‘t1500’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:25: 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & | ^ note: ‘t1500’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4516:85: 4516 | + t3288) | ^ Warning: ‘t150’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:18: 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & | ^ note: ‘t150’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4943:57: 4943 | t4887 = 0.1800000000e2_dp*t473*t1493*t4729 | ^ Warning: ‘t1493’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3061:83: 3061 | REAL(kind=dp) :: t1476, t1479, t1482, t1483, t1485, t1489, t149, t1492, t1493, t1496, t1498, & | ^ note: ‘t1493’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3342:31: 3342 | t250 = t149*t249 | ^ Warning: ‘t149’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3061:69: 3061 | REAL(kind=dp) :: t1476, t1479, t1482, t1483, t1485, t1489, t149, t1492, t1493, t1496, t1498, & | ^ note: ‘t149’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5405:59: 5405 | t6112 = 0.5555555556e-1_dp*t1246*t4553*t1483 | ^ Warning: ‘t1483’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3061:49: 3061 | REAL(kind=dp) :: t1476, t1479, t1482, t1483, t1485, t1489, t149, t1492, t1493, t1496, t1498, & | ^ note: ‘t1483’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5005:38: 5005 | + t5032 + t5035 | ^ Warning: ‘t1471’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3060:74: 3060 | t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470, t1471 | ^ note: ‘t1471’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4555:38: 4555 | t165*t171*t3449 | ^ Warning: ‘t1470’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3060:67: 3060 | t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470, t1471 | ^ note: ‘t1470’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5005:38: 5005 | + t5032 + t5035 | ^ Warning: ‘t1466’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3060:54: 3060 | t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470, t1471 | ^ note: ‘t1466’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5005:38: 5005 | + t5032 + t5035 | ^ Warning: ‘t1459’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3060:41: 3060 | t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470, t1471 | ^ note: ‘t1459’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5558:32: 5558 | t6557 = t1447*t59 | ^ Warning: ‘t1447’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3060:14: 3060 | t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470, t1471 | ^ note: ‘t1447’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5178:45: 5178 | t5535 = 0.640e2_dp*t1582*t1444 | ^ Warning: ‘t1444’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:97: 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & | ^ note: ‘t1444’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5197:53: 5197 | t5579 = 0.80e1_dp*t102*t327*t645*t1443 | ^ Warning: ‘t1443’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:90: 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & | ^ note: ‘t1443’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4927:59: 4927 | - 0.2400000000e2_dp*t786/t2492*t1058 | ^ Warning: ‘t1440’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:83: 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & | ^ note: ‘t1440’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4851:39: 4851 | *t289*t294*t1553 | ^ Warning: ‘t144’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:76: 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & | ^ note: ‘t144’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4614:34: 4614 | t3679 = t2565*t1439 | ^ Warning: ‘t1439’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:70: 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & | ^ note: ‘t1439’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5024:66: 5024 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 | ^ Warning: ‘t1438’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:63: 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & | ^ note: ‘t1438’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: 4622 | *t786*t1034*t1681 | ^ Warning: ‘t1429’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:49: 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & | ^ note: ‘t1429’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5146:46: 5146 | t5456 = 0.1280e3_dp*t1582*t1426 | ^ Warning: ‘t1426’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:42: 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & | ^ note: ‘t1426’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5156:55: 5156 | t5478 = 0.240e2_dp*t1616*t973*t645*t1425 | ^ Warning: ‘t1425’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:35: 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & | ^ note: ‘t1425’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5151:51: 5151 | t5468 = 0.2346666666e3_dp*t605*t1420 | ^ Warning: ‘t1420’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:28: 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & | ^ note: ‘t1420’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4870:96: 4870 | t3869 + t4657 + t4696) | ^ Warning: ‘t1411’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3058:94: 3058 | t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, t1411, & | ^ note: ‘t1411’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5416:58: 5416 | t6155 = 0.2500000000e0_dp*t1981*t4032*t1410 | ^ Warning: ‘t1410’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3058:87: 3058 | t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, t1411, & | ^ note: ‘t1410’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3485:108: 3485 | t46*t541))*sx | ^ Warning: ‘t141’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3058:80: 3058 | t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, t1411, & | ^ note: ‘t141’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4870:96: 4870 | t3869 + t4657 + t4696) | ^ Warning: ‘t1409’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3058:74: 3058 | t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, t1411, & | ^ note: ‘t1409’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3554:70: 3554 | *t165*t462*t561 + 0.3333333334e0_dp*t55*t57*t735 | ^ Warning: ‘t140’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3058:46: 3058 | t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, t1411, & | ^ note: ‘t140’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4497:80: 4497 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 | ^ Warning: ‘t14’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3058:40: 3058 | t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, t1411, & | ^ note: ‘t14’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5213:57: 5213 | t5622 = 0.1666666667e0_dp*t165*t1392*t4729 | ^ Warning: ‘t1392’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3058:21: 3058 | t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, t1411, & | ^ note: ‘t1392’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4814:44: 4814 | + (2*t147*t1284*t672) | ^ Warning: ‘t1388’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3058:14: 3058 | t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, t1411, & | ^ note: ‘t1388’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4842:60: 4842 | + 0.2500000000e0_dp*t1981*t2707*t1410 | ^ Warning: ‘t1387’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:96: 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & | ^ note: ‘t1387’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4806:41: 4806 | *t1246*t3244*t1483 | ^ Warning: ‘t1377’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:89: 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & | ^ note: ‘t1377’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5138:39: 5138 | t5432 = t1373*t446*t5430 | ^ Warning: ‘t1373’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:82: 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & | ^ note: ‘t1373’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5031:34: 5031 | *t105*t5118 | ^ Warning: ‘t137’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:68: 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & | ^ note: ‘t137’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4555:38: 4555 | t165*t171*t3449 | ^ Warning: ‘t1368’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:62: 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & | ^ note: ‘t1368’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4823:58: 4823 | + 0.3333333334e0_dp*t165*t437*t1688 | ^ Warning: ‘t1360’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:48: 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & | ^ note: ‘t1360’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3378:31: 3378 | t328 = t136*t233 | ^ Warning: ‘t136’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:41: 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & | ^ note: ‘t136’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4798:66: 4798 | *t1410 - 0.1666666667e0_dp*t429*t1392*t1410 | ^ Warning: ‘t1348’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:35: 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & | ^ note: ‘t1348’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4682:40: 4682 | *t400*t1333*t1410 | ^ Warning: ‘t1340’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:21: 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & | ^ note: ‘t1340’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5220:57: 5220 | t5641 = 0.1500000000e1_dp*t405*t1333*t4729 | ^ Warning: ‘t1333’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:14: 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & | ^ note: ‘t1333’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3517:73: 3517 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 | ^ Warning: ‘t133’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:92: 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & | ^ note: ‘t133’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4695:34: 4695 | t1320*t1483 | ^ Warning: ‘t1320’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:86: 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & | ^ note: ‘t1320’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3517:73: 3517 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 | ^ Warning: ‘t132’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:79: 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & | ^ note: ‘t132’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4695:34: 4695 | t1320*t1483 | ^ Warning: ‘t1316’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:73: 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & | ^ note: ‘t1316’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4308:43: 4308 | t2565 = t126/t131/t1056/t130 | ^ Warning: ‘t131’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:66: 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & | ^ note: ‘t131’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5231:57: 5231 | t5670 = 0.2250000000e1_dp*t400*t1309*t4729 | ^ Warning: ‘t1309’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:60: 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & | ^ note: ‘t1309’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5235:57: 5235 | t5679 = 0.1875000000e1_dp*t1302*t406*t5002 | ^ Warning: ‘t1302’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:53: 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & | ^ note: ‘t1302’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4672:33: 4672 | t3939 = t1301*t245 | ^ Warning: ‘t1301’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:46: 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & | ^ note: ‘t1301’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5488:54: 5488 | + 0.4500000000e1_dp*t2009*t4744 | ^ Warning: ‘t1300’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:39: 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & | ^ note: ‘t1300’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4308:43: 4308 | t2565 = t126/t131/t1056/t130 | ^ Warning: ‘t130’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:32: 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & | ^ note: ‘t130’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3580:44: 3580 | t796 = 0.1e1_dp/t787/t13*t795 | ^ Warning: ‘t13’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:26: 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & | ^ note: ‘t13’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5136:57: 5136 | t5429 = 0.1666666667e0_dp*t445*t1292*t5143 | ^ Warning: ‘t1292’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:21: 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & | ^ note: ‘t1292’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4814:44: 4814 | + (2*t147*t1284*t672) | ^ Warning: ‘t1284’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:96: 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & | ^ note: ‘t1284’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4791:39: 4791 | *t429*t1928*t290 | ^ Warning: ‘t1283’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:89: 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & | ^ note: ‘t1283’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4833:71: 4833 | *t3507 - t3512)*t149*t160 | ^ Warning: ‘t1275’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:82: 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & | ^ note: ‘t1275’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4798:66: 4798 | *t1410 - 0.1666666667e0_dp*t429*t1392*t1410 | ^ Warning: ‘t1264’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:68: 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & | ^ note: ‘t1264’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3517:73: 3517 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 | ^ Warning: ‘t126’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:61: 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & | ^ note: ‘t126’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5269:59: 5269 | t5776 = 0.2777777778e-1_dp*t1246*t1247*t5009 | ^ Warning: ‘t1247’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:48: 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & | ^ note: ‘t1247’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5269:59: 5269 | t5776 = 0.2777777778e-1_dp*t1246*t1247*t5009 | ^ Warning: ‘t1246’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:41: 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & | ^ note: ‘t1246’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4782:66: 4782 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 | ^ Warning: ‘t1235’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:20: 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & | ^ note: ‘t1235’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4439:76: 4439 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 | ^ Warning: ‘t123’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:13: 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & | ^ note: ‘t123’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4762:66: 4762 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 | ^ Warning: ‘t1224’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:95: 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & | ^ note: ‘t1224’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4768:67: 4768 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 | ^ Warning: ‘t1221’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:88: 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & | ^ note: ‘t1221’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3391:81: 3391 | t360 = 0.28e2_dp/0.3e1_dp*t122*t114 - 0.28e2_dp/0.3e1_dp*t356*t357 | ^ Warning: ‘t122’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:81: 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & | ^ note: ‘t122’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4774:64: 4774 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 | ^ Warning: ‘t1216’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:75: 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & | ^ note: ‘t1216’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4755:41: 4755 | t192*t68*t4256*t65 | ^ Warning: ‘t1213’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:68: 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & | ^ note: ‘t1213’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4726:37: 4726 | *t58*t3796*t71 | ^ Warning: ‘t1207’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:54: 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & | ^ note: ‘t1207’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4768:67: 4768 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 | ^ Warning: ‘t1201’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:40: 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & | ^ note: ‘t1201’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4762:66: 4762 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 | ^ Warning: ‘t1200’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:33: 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & | ^ note: ‘t1200’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4575:35: 4575 | t3546 = 0.1e1_dp/t12 | ^ Warning: ‘t12’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:26: 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & | ^ note: ‘t12’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4782:66: 4782 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 | ^ Warning: ‘t1194’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:76: 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 | ^ note: ‘t1194’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4712:66: 4712 | *t1722 + 0.3703703706e0_dp*t1193*t1505*t451 | ^ Warning: ‘t1193’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:69: 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 | ^ note: ‘t1193’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4782:66: 4782 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 | ^ Warning: ‘t1192’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:62: 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 | ^ note: ‘t1192’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: 4613 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: ‘t119’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:48: 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 | ^ note: ‘t119’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4782:66: 4782 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 | ^ Warning: ‘t1189’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:42: 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 | ^ note: ‘t1189’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4747:29: 4747 | *t3382 | ^ Warning: ‘t1176’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:35: 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 | ^ note: ‘t1176’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4806:41: 4806 | *t1246*t3244*t1483 | ^ Warning: ‘t1172’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:28: 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 | ^ note: ‘t1172’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4806:41: 4806 | *t1246*t3244*t1483 | ^ Warning: ‘t1168’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:21: 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 | ^ note: ‘t1168’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4737:39: 4737 | *t478*t183*t3918 | ^ Warning: ‘t1161’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:14: 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 | ^ note: ‘t1161’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3517:73: 3517 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 | ^ Warning: ‘t116’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:95: 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & | ^ note: ‘t116’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4747:29: 4747 | *t3382 | ^ Warning: ‘t1157’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:89: 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & | ^ note: ‘t1157’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5300:57: 5300 | t5864 = 0.1800000000e2_dp*t473*t1150*t4729 | ^ Warning: ‘t1150’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:82: 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & | ^ note: ‘t1150’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3959:50: 3959 | t1636 = 0.5600000000e2_dp*t624*t115 | ^ Warning: ‘t115’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:75: 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & | ^ note: ‘t115’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5277:57: 5277 | t5801 = 0.3600000000e2_dp*t1143*t479*t5002 | ^ Warning: ‘t1143’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:69: 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & | ^ note: ‘t1143’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4738:33: 4738 | t4230 = t1142*t262 | ^ Warning: ‘t1142’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:62: 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & | ^ note: ‘t1142’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5385:63: 5385 | t6074 = 0.8099999996e2_dp*t496*t4769*t1141*t4915 | ^ Warning: ‘t1141’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:55: 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & | ^ note: ‘t1141’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3391:81: 3391 | t360 = 0.28e2_dp/0.3e1_dp*t122*t114 - 0.28e2_dp/0.3e1_dp*t356*t357 | ^ Warning: ‘t114’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:41: 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & | ^ note: ‘t114’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4762:66: 4762 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 | ^ Warning: ‘t1137’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:35: 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & | ^ note: ‘t1137’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4762:66: 4762 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 | ^ Warning: ‘t1134’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:28: 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & | ^ note: ‘t1134’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4774:64: 4774 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 | ^ Warning: ‘t1129’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:21: 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & | ^ note: ‘t1129’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4726:37: 4726 | *t58*t3796*t71 | ^ Warning: ‘t1126’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:14: 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & | ^ note: ‘t1126’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4768:67: 4768 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 | ^ Warning: ‘t1125’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:95: 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ note: ‘t1125’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4762:66: 4762 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 | ^ Warning: ‘t1122’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:88: 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ note: ‘t1122’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5191:33: 5191 | t5565 = t112*t1685 | ^ Warning: ‘t112’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:81: 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ note: ‘t112’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4768:67: 4768 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 | ^ Warning: ‘t1119’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:75: 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ note: ‘t1119’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4726:37: 4726 | *t58*t3796*t71 | ^ Warning: ‘t1111’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:68: 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ note: ‘t1111’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4774:64: 4774 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 | ^ Warning: ‘t1109’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:61: 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ note: ‘t1109’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4712:66: 4712 | *t1722 + 0.3703703706e0_dp*t1193*t1505*t451 | ^ Warning: ‘t1106’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:54: 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ note: ‘t1106’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4755:41: 4755 | t192*t68*t4256*t65 | ^ Warning: ‘t1101’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:47: 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ note: ‘t1101’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4842:60: 4842 | + 0.2500000000e0_dp*t1981*t2707*t1410 | ^ Warning: ‘t1100’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:40: 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ note: ‘t1100’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3380:30: 3380 | t332 = t11*t114 | ^ Warning: ‘t11’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:33: 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ note: ‘t11’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4755:41: 4755 | t192*t68*t4256*t65 | ^ Warning: ‘t1097’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:21: 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ note: ‘t1097’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4842:60: 4842 | + 0.2500000000e0_dp*t1981*t2707*t1410 | ^ Warning: ‘t1093’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:14: 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ note: ‘t1093’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4806:41: 4806 | *t1246*t3244*t1483 | ^ Warning: ‘t1085’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3050:89: 3050 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & | ^ note: ‘t1085’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3512:42: 3512 | t635 = -4*t108 + 4*t332*rho | ^ Warning: ‘t108’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3050:75: 3050 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & | ^ note: ‘t108’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5090:57: 5090 | t5311 = 0.1666666668e0_dp*t289*t1071*t4701 | ^ Warning: ‘t1071’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3050:55: 3050 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & | ^ note: ‘t1071’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3517:73: 3517 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 | ^ Warning: ‘t107’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3050:48: 3050 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & | ^ note: ‘t107’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4825:33: 4825 | t4575 = t1067*t561 | ^ Warning: ‘t1067’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3050:35: 3050 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & | ^ note: ‘t1067’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4603:29: 4603 | *t3339 | ^ Warning: ‘t1064’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3050:28: 3050 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & | ^ note: ‘t1064’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4629:39: 4629 | *t321*t953*t1625 | ^ Warning: ‘t1063’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3050:21: 3050 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & | ^ note: ‘t1063’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5497:40: 5497 | *t1054*t640*t3679 | ^ Warning: ‘t1060’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3050:14: 3050 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & | ^ note: ‘t1060’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4233:31: 4233 | t2204 = t10*t106 | ^ Warning: ‘t106’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:95: 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & | ^ note: ‘t106’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4927:59: 4927 | - 0.2400000000e2_dp*t786/t2492*t1058 | ^ Warning: ‘t1058’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:82: 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & | ^ note: ‘t1058’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5172:67: 5172 | *t5511 + 0.1200000000e3_dp*t1055*t2565*t4721 | ^ Warning: ‘t1055’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:68: 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & | ^ note: ‘t1055’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5497:40: 5497 | *t1054*t640*t3679 | ^ Warning: ‘t1054’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:61: 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & | ^ note: ‘t1054’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: 4622 | *t786*t1034*t1681 | ^ Warning: ‘t1050’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:54: 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & | ^ note: ‘t1050’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3337:31: 3337 | t234 = t105*t233 | ^ Warning: ‘t105’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:47: 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & | ^ note: ‘t105’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: 4613 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: ‘t1046’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:41: 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & | ^ note: ‘t1046’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: 4613 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: ‘t1044’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:34: 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & | ^ note: ‘t1044’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3371:30: 3371 | t316 = t97*t104 | ^ Warning: ‘t104’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:20: 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & | ^ note: ‘t104’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: 4622 | *t786*t1034*t1681 | ^ Warning: ‘t1036’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:14: 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & | ^ note: ‘t1036’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: 4622 | *t786*t1034*t1681 | ^ Warning: ‘t1034’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:96: 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ note: ‘t1034’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: 4622 | *t786*t1034*t1681 | ^ Warning: ‘t1030’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:82: 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ note: ‘t1030’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3648:29: 3648 | t972 = t103**2 | ^ Warning: ‘t103’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:75: 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ note: ‘t103’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: 4622 | *t786*t1034*t1681 | ^ Warning: ‘t1026’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:69: 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ note: ‘t1026’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: 4622 | *t786*t1034*t1681 | ^ Warning: ‘t1024’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:62: 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ note: ‘t1024’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: 4622 | *t786*t1034*t1681 | ^ Warning: ‘t1021’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:55: 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ note: ‘t1021’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5175:43: 5175 | t5528 = t102*t327*t1684*t557 | ^ Warning: ‘t102’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:48: 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ note: ‘t102’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4536:32: 4536 | t12*t1058 | ^ Warning: ‘t1014’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:35: 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ note: ‘t1014’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: 4622 | *t786*t1034*t1681 | ^ Warning: ‘t1012’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:28: 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ note: ‘t1012’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: 4622 | *t786*t1034*t1681 | ^ Warning: ‘t1008’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:21: 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ note: ‘t1008’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: 4613 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: ‘t1004’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:14: 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ note: ‘t1004’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4603:29: 4603 | *t3339 | ^ Warning: ‘t1000’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3047:84: 3047 | REAL(kind=dp) :: Cx, epsilon_rho43, my_epsilon_rho, ndrho, rho, t1, t10, t1000, t1002, & | ^ note: ‘t1000’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3667:50: 3667 | t1019 = 0.1e1_dp/t19/t1014*t787*t10 | ^ Warning: ‘t10’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3047:77: 3047 | REAL(kind=dp) :: Cx, epsilon_rho43, my_epsilon_rho, ndrho, rho, t1, t10, t1000, t1002, & | ^ note: ‘t10’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: 1841 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: ‘t997’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:400:30: 400 | t99, t991, t995, t997, xx | ^ note: ‘t997’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2388:54: 2388 | t5487 = 0.2160000000e3_dp*t7*t995*t1652 | ^ Warning: ‘t995’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:400:24: 400 | t99, t991, t995, t997, xx | ^ note: ‘t995’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: 1841 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: ‘t991’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:400:18: 400 | t99, t991, t995, t997, xx | ^ note: ‘t991’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2259:34: 2259 | *t105*t5118 | ^ Warning: ‘t99’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:400:12: 400 | t99, t991, t995, t997, xx | ^ note: ‘t99’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: 1841 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: ‘t987’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:95: 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: ‘t987’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1831:29: 1831 | *t3339 | ^ Warning: ‘t984’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:89: 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: ‘t984’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t980’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:77: 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: ‘t980’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2418:50: 2418 | t5564 = 0.1173333333e3_dp*t5060*t98 | ^ Warning: ‘t98’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:71: 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: ‘t98’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1865:33: 1865 | *t339*t969 | ^ Warning: ‘t976’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:60: 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: ‘t976’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1857:39: 1857 | *t321*t953*t1625 | ^ Warning: ‘t974’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:48: 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: ‘t974’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1865:33: 1865 | *t339*t969 | ^ Warning: ‘t973’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:42: 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: ‘t973’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:738:30: 738 | t627 = t97*t132 | ^ Warning: ‘t97’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:30: 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: ‘t97’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1865:33: 1865 | *t339*t969 | ^ Warning: ‘t969’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:25: 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: ‘t969’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t966’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:19: 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: ‘t966’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1831:29: 1831 | *t3339 | ^ Warning: ‘t963’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:13: 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: ‘t963’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1865:33: 1865 | *t339*t969 | ^ Warning: ‘t962’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:398:92: 398 | REAL(KIND=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & | ^ note: ‘t962’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1831:29: 1831 | *t3339 | ^ Warning: ‘t959’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:398:86: 398 | REAL(KIND=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & | ^ note: ‘t959’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t955’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:398:74: 398 | REAL(KIND=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & | ^ note: ‘t955’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2429:56: 2429 | t5593 = 0.1066666667e2_dp*t321*t953*t5087 | ^ Warning: ‘t953’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:398:62: 398 | REAL(KIND=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & | ^ note: ‘t953’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1865:33: 1865 | *t339*t969 | ^ Warning: ‘t950’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:398:56: 398 | REAL(KIND=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & | ^ note: ‘t950’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:611:38: 611 | t341 = 0.1e1_dp/t19/t95 | ^ Warning: ‘t95’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:398:50: 398 | REAL(KIND=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & | ^ note: ‘t95’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2435:56: 2435 | t5607 = 0.5866666667e2_dp*t307*t949*t5069 | ^ Warning: ‘t949’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:398:45: 398 | REAL(KIND=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & | ^ note: ‘t949’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t946’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:398:39: 398 | REAL(KIND=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & | ^ note: ‘t946’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1857:39: 1857 | *t321*t953*t1625 | ^ Warning: ‘t941’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:76: 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: ‘t941’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1843:31: 1843 | t3682 = t24*t940 | ^ Warning: ‘t940’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:70: 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: ‘t940’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1466:70: 1466 | *t371 - 0.4266666668e2_dp*t2220/t1014/t94*t1058 | ^ Warning: ‘t94’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:64: 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: ‘t94’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1865:33: 1865 | *t339*t969 | ^ Warning: ‘t930’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:59: 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: ‘t930’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2417:50: 2417 | t5562 = 0.5866666667e2_dp*t93*t4820 | ^ Warning: ‘t93’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:53: 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: ‘t93’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t929’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:48: 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: ‘t929’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1893:39: 1893 | *t165*t3865*t237 | ^ Warning: ‘t922’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:30: 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: ‘t922’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:590:29: 590 | t298 = t92*t97 | ^ Warning: ‘t92’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:24: 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: ‘t92’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2079:39: 2079 | *t289*t294*t1553 | ^ Warning: ‘t918’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:19: 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: ‘t918’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2087:42: 2087 | *t83*t45*t3581*t140 | ^ Warning: ‘t914’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:13: 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: ‘t914’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2026:66: 2026 | *t1410 - 0.1666666667e0_dp*t429*t1392*t1410 | ^ Warning: ‘t907’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:94: 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: ‘t907’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1879:71: 1879 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 | ^ Warning: ‘t906’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:88: 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: ‘t906’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1189:39: 1189 | t1640 = 0.1e1_dp/t787/t9 | ^ Warning: ‘t9’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:76: 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: ‘t9’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2670:57: 2670 | t6216 = 0.8333333340e-1_dp*t429*t897*t4701 | ^ Warning: ‘t897’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:72: 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: ‘t897’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2098:96: 2098 | t3869 + t4657 + t4696) | ^ Warning: ‘t893’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:60: 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: ‘t893’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1947:70: 1947 | *t508*t1769 - 0.1111111112e0_dp*t192*t1837*t267 | ^ Warning: ‘t886’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:48: 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: ‘t886’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1947:70: 1947 | *t508*t1769 - 0.1111111112e0_dp*t192*t1837*t267 | ^ Warning: ‘t882’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:42: 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: ‘t882’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:749:49: 749 | *t615 - 0.20e1_dp*t102*t646 | ^ Warning: ‘t88’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:30: 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: ‘t88’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2010:66: 2010 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 | ^ Warning: ‘t878’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:25: 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: ‘t878’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1990:66: 1990 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 | ^ Warning: ‘t874’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:13: 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: ‘t874’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:745:73: 745 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 | ^ Warning: ‘t87’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:93: 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: ‘t87’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1954:37: 1954 | *t58*t3796*t71 | ^ Warning: ‘t866’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:82: 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: ‘t866’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1983:41: 1983 | t192*t68*t4256*t65 | ^ Warning: ‘t865’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:76: 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: ‘t865’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1940:66: 1940 | *t1722 + 0.3703703706e0_dp*t1193*t1505*t451 | ^ Warning: ‘t864’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:70: 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: ‘t864’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1990:66: 1990 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 | ^ Warning: ‘t863’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:64: 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: ‘t863’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1725:80: 1725 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 | ^ Warning: ‘t86’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:52: 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: ‘t86’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1975:29: 1975 | *t3382 | ^ Warning: ‘t859’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:47: 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: ‘t859’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1787:56: 1787 | t3497 = 0.2400000000e2_dp*t473*t852*t1483 | ^ Warning: ‘t852’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:29: 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: ‘t852’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1466:70: 1466 | *t371 - 0.4266666668e2_dp*t2220/t1014/t94*t1058 | ^ Warning: ‘t85’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:17: 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: ‘t85’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:713:98: 713 | t46*t541))*sx | ^ Warning: ‘t84’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:12: 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: ‘t84’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2061:71: 2061 | *t3507 - t3512)*t149*t160 | ^ Warning: ‘t833’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:94: 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: ‘t833’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2654:37: 2654 | t6175 = t83*t597*t1688 | ^ Warning: ‘t83’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:88: 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: ‘t83’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1783:38: 1783 | t165*t171*t3449 | ^ Warning: ‘t827’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:83: 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: ‘t827’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1910:40: 1910 | *t400*t1333*t1410 | ^ Warning: ‘t822’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:71: 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: ‘t822’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1783:38: 1783 | t165*t171*t3449 | ^ Warning: ‘t815’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:65: 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: ‘t815’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2098:96: 2098 | t3869 + t4657 + t4696) | ^ Warning: ‘t804’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:59: 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: ‘t804’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t801’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:53: 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: ‘t801’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t800’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:47: 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: ‘t800’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:786:108: 786 | *t83*t653 - 0.2222222224e0_dp*t144*t46*t739))*sx | ^ Warning: ‘t8’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:41: 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: ‘t8’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1764:32: 1764 | t12*t1058 | ^ Warning: ‘t797’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:37: 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: ‘t797’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:713:98: 713 | t46*t541))*sx | ^ Warning: ‘t79’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:95: 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: ‘t79’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2107:42: 2107 | t4721 = 0.1e1_dp/t787*t2480 | ^ Warning: ‘t787’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:90: 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: ‘t787’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2155:59: 2155 | - 0.2400000000e2_dp*t786/t2492*t1058 | ^ Warning: ‘t786’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:84: 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: ‘t786’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1764:32: 1764 | t12*t1058 | ^ Warning: ‘t782’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:72: 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: ‘t782’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1744:85: 1744 | + t3288) | ^ Warning: ‘t78’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:66: 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: ‘t78’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1898:32: 1898 | t3925 = t777*t561 | ^ Warning: ‘t777’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:61: 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: ‘t777’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1831:29: 1831 | *t3339 | ^ Warning: ‘t773’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:49: 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: ‘t773’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1857:39: 1857 | *t321*t953*t1625 | ^ Warning: ‘t772’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:43: 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: ‘t772’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t769’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:37: 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: ‘t769’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1770:57: 1770 | *t102*t3363 - 0.20e1_dp*t102*t3379 | ^ Warning: ‘t766’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:31: 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: ‘t766’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: 1841 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: ‘t764’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:19: 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: ‘t764’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2098:96: 2098 | t3869 + t4657 + t4696) | ^ Warning: ‘t754’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:13: 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: ‘t754’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2098:96: 2098 | t3869 + t4657 + t4696) | ^ Warning: ‘t753’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:95: 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t753’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2112:55: 2112 | t4732 = 0.6666666672e0_dp*t747*t84*t4729 | ^ Warning: ‘t747’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:89: 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t747’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:661:32: 661 | t446 = t74*my_rho | ^ Warning: ‘t74’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:83: 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t74’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1219:31: 1219 | t1694 = t45*t739 | ^ Warning: ‘t739’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:78: 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t739’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2019:39: 2019 | *t429*t1928*t290 | ^ Warning: ‘t735’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:72: 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t735’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2607:33: 2607 | t6053 = t732*t6052 | ^ Warning: ‘t732’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:66: 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t732’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2572:51: 2572 | t5977 = 0.1111111112e0_dp*t1755*t729 | ^ Warning: ‘t729’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:60: 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t729’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1940:66: 1940 | *t1722 + 0.3703703706e0_dp*t1193*t1505*t451 | ^ Warning: ‘t728’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:54: 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t728’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2614:33: 2614 | t6075 = t723*t6052 | ^ Warning: ‘t723’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:48: 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t723’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2785:54: 2785 | + t5949 + t5952 + t5954 - t5958 | ^ Warning: ‘t722’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:42: 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t722’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2585:33: 2585 | t6006 = t719*t1838 | ^ Warning: ‘t719’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:36: 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t719’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2293:90: 2293 | t729 - 0.5555555558e-1_dp*t192*t5271 - 0.5000000001e0_dp*t732*t4908 | ^ Warning: ‘t716’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:30: 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t716’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1231:31: 1231 | t1715 = t713*t67 | ^ Warning: ‘t713’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:24: 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t713’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1277:51: 1277 | t1797 = 0.8999999998e1_dp*t1795*t710 | ^ Warning: ‘t710’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:18: 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t710’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:777:87: 777 | t200 - 0.5555555558e-1_dp*t192*t729 - 0.5000000001e0_dp*t732*t709 | ^ Warning: ‘t71’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:12: 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: ‘t71’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1268:51: 1268 | t1779 = 0.5000000001e0_dp*t1777*t709 | ^ Warning: ‘t709’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:93: 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: ‘t709’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2293:90: 2293 | t729 - 0.5555555558e-1_dp*t192*t5271 - 0.5000000001e0_dp*t732*t4908 | ^ Warning: ‘t708’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:87: 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: ‘t708’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1425:33: 1425 | t2114 = t707*t2113 | ^ Warning: ‘t707’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:81: 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: ‘t707’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2612:42: 2612 | t6066 = t1519*t705*t561*t65 | ^ Warning: ‘t705’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:75: 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: ‘t705’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: ‘t70’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:69: 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: ‘t70’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:602:29: 602 | t321 = t7*t219 | ^ Warning: ‘t7’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:64: 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: ‘t7’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1679:30: 1679 | t3097 = t66*t69 | ^ Warning: ‘t69’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:60: 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: ‘t69’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1346:56: 1346 | t1952 = 0.5555555557e-1_dp*t165*t689*t433 | ^ Warning: ‘t689’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:55: 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: ‘t689’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:647:30: 647 | t406 = t68*t140 | ^ Warning: ‘t68’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:49: 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: ‘t68’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2135:73: 2135 | *t165*t166*t4729 + 0.3333333334e0_dp*t55*t57*t4782 | ^ Warning: ‘t679’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:44: 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: ‘t679’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2820:76: 2820 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) | ^ Warning: ‘t673’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:38: 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: ‘t673’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2646:38: 2646 | t6160 = t147*t1885*t672 | ^ Warning: ‘t672’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:32: 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: ‘t672’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1367:55: 1367 | t1997 = 0.1666666667e0_dp*t165*t171*t668 | ^ Warning: ‘t668’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:390:76: 390 | t6603, t6611, t6620, t6621, t6630, t6640, t6658, t6665, t6669, t668 | ^ note: ‘t668’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:686:30: 686 | t516 = t66*t515 | ^ Warning: ‘t66’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:389:92: 389 | t650, t6509, t6529, t653, t6539, t6554, t6557, t6569, t657, t658, t6583, t6596, t66, & | ^ note: ‘t66’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2642:38: 2642 | t6141 = t658*t575*t1925 | ^ Warning: ‘t658’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:389:73: 389 | t650, t6509, t6529, t653, t6539, t6554, t6557, t6569, t657, t658, t6583, t6596, t66, & | ^ note: ‘t658’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1218:49: 1218 | t1693 = 0.3333333336e0_dp*t55*t653 | ^ Warning: ‘t653’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:389:33: 389 | t650, t6509, t6529, t653, t6539, t6554, t6557, t6569, t657, t658, t6583, t6596, t66, & | ^ note: ‘t653’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1131:49: 1131 | t1545 = 0.3333333336e0_dp*t55*t650 | ^ Warning: ‘t650’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:389:13: 389 | t650, t6509, t6529, t653, t6539, t6554, t6557, t6569, t657, t658, t6583, t6596, t66, & | ^ note: ‘t650’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:725:59: 725 | *t71 - 0.5000000001e0_dp*t60*t561*t65 | ^ Warning: ‘t65’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:388:93: 388 | t6415, t6428, t6433, t6442, t645, t6451, t646, t6461, t6479, t649, t6490, t6499, t65, & | ^ note: ‘t65’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1324:31: 1324 | t1902 = t68*t649 | ^ Warning: ‘t649’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:388:74: 388 | t6415, t6428, t6433, t6442, t645, t6451, t646, t6461, t6479, t649, t6490, t6499, t65, & | ^ note: ‘t649’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2259:34: 2259 | *t105*t5118 | ^ Warning: ‘t646’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:388:54: 388 | t6415, t6428, t6433, t6442, t645, t6451, t646, t6461, t6479, t649, t6490, t6499, t65, & | ^ note: ‘t646’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2425:53: 2425 | t5579 = 0.80e1_dp*t102*t327*t645*t1443 | ^ Warning: ‘t645’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:388:41: 388 | t6415, t6428, t6433, t6442, t645, t6451, t646, t6461, t6479, t649, t6490, t6499, t65, & | ^ note: ‘t645’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1397:32: 1397 | t2054 = t786*t640 | ^ Warning: ‘t640’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:387:88: 387 | t6344, t635, t6352, t6363, t6367, t637, t6370, t6373, t6375, t6380, t6389, t640, t6400, & | ^ note: ‘t640’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2252:66: 2252 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 | ^ Warning: ‘t637’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:387:47: 387 | t6344, t635, t6352, t6363, t6367, t637, t6370, t6373, t6375, t6380, t6389, t640, t6400, & | ^ note: ‘t637’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2252:66: 2252 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 | ^ Warning: ‘t635’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:387:20: 387 | t6344, t635, t6352, t6363, t6367, t637, t6370, t6373, t6375, t6380, t6389, t640, t6400, & | ^ note: ‘t635’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2252:66: 2252 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 | ^ Warning: ‘t628’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:386:40: 386 | t6267, t6268, t627, t6271, t628, t6281, t6283, t6290, t6291, t63, t6308, t6338, t6339, & | ^ note: ‘t628’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2385:51: 2385 | t5480 = 0.1760000000e3_dp*t5060*t627 | ^ Warning: ‘t627’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:386:27: 386 | t6267, t6268, t627, t6271, t628, t6281, t6283, t6290, t6291, t63, t6308, t6338, t6339, & | ^ note: ‘t627’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2428:56: 2428 | t5590 = 0.80e1_dp*t624*t22*t326*t136*t233 | ^ Warning: ‘t624’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:385:41: 385 | t6219, t6222, t6223, t6227, t624, t6247, t6249, t6252, t6253, t6256, t6257, t6260, t6263, & | ^ note: ‘t624’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:678:35: 678 | *t61*t262*t25 | ^ Warning: ‘t62’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:384:61: 384 | REAL(KIND=dp) :: t6186, t6189, t6192, t6194, t6198, t62, t6201, t6207, t6210, t6213, t6216, & | ^ note: ‘t62’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2259:34: 2259 | *t105*t5118 | ^ Warning: ‘t615’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:382:96: 382 | t6112, t6116, t6119, t6123, t6126, t6129, t6132, t6136, t6138, t614, t6141, t6144, t615, & | ^ note: ‘t615’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1168:32: 1168 | t1608 = t953*t614 | ^ Warning: ‘t614’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:382:76: 382 | t6112, t6116, t6119, t6123, t6126, t6129, t6132, t6136, t6138, t614, t6141, t6144, t615, & | ^ note: ‘t614’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:573:34: 573 | t264 = t61*t262*t17 | ^ Warning: ‘t61’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:381:73: 381 | t6078, t6079, t608, t6087, t609, t6090, t6091, t6094, t6099, t61, t6102, t6106, t6109, & | ^ note: ‘t61’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2259:34: 2259 | *t105*t5118 | ^ Warning: ‘t609’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:381:40: 381 | t6078, t6079, t608, t6087, t609, t6090, t6091, t6094, t6099, t61, t6102, t6106, t6109, & | ^ note: ‘t609’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1157:32: 1157 | t1592 = t949*t608 | ^ Warning: ‘t608’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:381:27: 381 | t6078, t6079, t608, t6087, t609, t6090, t6091, t6094, t6099, t61, t6102, t6106, t6109, & | ^ note: ‘t608’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t605’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:380:34: 380 | t6044, t6047, t6049, t605, t6052, t6053, t6056, t6058, t6060, t6063, t6066, t6074, t6075, & | ^ note: ‘t605’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1265:31: 1265 | t1774 = t60*t496 | ^ Warning: ‘t60’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:378:64: 378 | t5977, t5978, t598, t5985, t5990, t5994, t5996, t6, t60, t6000, t6002, t6004, t6006, & | ^ note: ‘t60’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:621:33: 621 | t365 = t6*my_ndrho | ^ Warning: ‘t6’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:378:59: 378 | t5977, t5978, t598, t5985, t5990, t5994, t5996, t6, t60, t6000, t6002, t6004, t6006, & | ^ note: ‘t6’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1130:49: 1130 | t1543 = 0.3333333336e0_dp*t55*t598 | ^ Warning: ‘t598’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:378:27: 378 | t5977, t5978, t598, t5985, t5990, t5994, t5996, t6, t60, t6000, t6002, t6004, t6006, & | ^ note: ‘t598’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2654:37: 2654 | t6175 = t83*t597*t1688 | ^ Warning: ‘t597’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:377:76: 377 | REAL(KIND=dp) :: t5954, t5956, t5958, t5960, t5963, t5964, t5966, t597, t5971, t5973, t5975, & | ^ note: ‘t597’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1363:56: 1363 | t1987 = 0.8333333335e-1_dp*t429*t437*t593 | ^ Warning: ‘t593’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:376:20: 376 | t5929, t593, t5932, t5938, t5940, t5942, t5944, t5949, t5952 | ^ note: ‘t593’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1068:50: 1068 | t1408 = 0.4444444448e0_dp*t214*t590 | ^ Warning: ‘t590’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:375:32: 375 | t5891, t5898, t59, t590, t5902, t5905, t5908, t5911, t5913, t5918, t5922, t5925, t5926, & | ^ note: ‘t590’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:762:30: 762 | t707 = t187*t59 | ^ Warning: ‘t59’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:375:26: 375 | t5891, t5898, t59, t590, t5902, t5905, t5908, t5911, t5913, t5918, t5922, t5925, t5926, & | ^ note: ‘t59’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2145:60: 2145 | t4812 = 0.1333333334e1_dp*t217*t46*t589*t1447 | ^ Warning: ‘t589’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:374:97: 374 | t5850, t5854, t5857, t5861, t5864, t5868, t5869, t5875, t5880, t5881, t5885, t5888, t589, & | ^ note: ‘t589’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1350:34: 1350 | t1962 = t585*my_rho | ^ Warning: ‘t585’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:373:97: 373 | t5819, t5822, t5825, t5828, t5830, t5831, t5833, t5835, t5838, t5841, t5845, t5848, t585, & | ^ note: ‘t585’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:576:30: 576 | t268 = t58*t237 | ^ Warning: ‘t58’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:372:53: 372 | t5786, t5789, t579, t5792, t5795, t5797, t58, t5801, t5804, t5807, t5810, t5813, t5816, & | ^ note: ‘t58’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2010:66: 2010 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 | ^ Warning: ‘t579’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:372:27: 372 | t5786, t5789, t579, t5792, t5795, t5797, t58, t5801, t5804, t5807, t5810, t5813, t5816, & | ^ note: ‘t579’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1414:39: 1414 | t2081*t575*t2082 | ^ Warning: ‘t575’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:371:34: 371 | t5742, t5745, t5749, t575, t5752, t5756, t5760, t5767, t5770, t5773, t5776, t5780, t5783, & | ^ note: ‘t575’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:847:69: 847 | *t170*t455*t17 + 0.3333333334e0_dp*t55*t57*t889 | ^ Warning: ‘t57’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:369:67: 369 | t5686, t5689, t569, t5692, t5695, t5696, t5698, t5699, t57, t5701, t5705 | ^ note: ‘t57’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2709:36: 2709 | t5011 + t5001 | ^ Warning: ‘t569’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:369:27: 369 | t5686, t5689, t569, t5692, t5695, t5696, t5698, t5699, t57, t5701, t5705 | ^ note: ‘t569’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2135:73: 2135 | *t165*t166*t4729 + 0.3333333334e0_dp*t55*t57*t4782 | ^ Warning: ‘t567’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:368:54: 368 | t5657, t566, t5660, t5663, t5666, t5667, t567, t5670, t5671, t5673, t5676, t5679, t5682, & | ^ note: ‘t567’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1345:56: 1345 | t1946 = 0.1666666667e0_dp*t165*t1392*t561 | ^ Warning: ‘t561’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:366:67: 366 | t5593, t5595, t5597, t56, t5600, t5602, t5604, t5607, t561, t5610, t5611, t5613, t5619, & | ^ note: ‘t561’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:673:30: 673 | t479 = t56*t140 | ^ Warning: ‘t56’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:366:33: 366 | t5593, t5595, t5597, t56, t5600, t5602, t5604, t5607, t561, t5610, t5611, t5613, t5619, & | ^ note: ‘t56’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2259:34: 2259 | *t105*t5118 | ^ Warning: ‘t558’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:365:75: 365 | t5562, t5564, t5565, t5568, t557, t5572, t5574, t5575, t5579, t558, t5581, t5585, t5590, & | ^ note: ‘t558’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2721:79: 2721 | *t327*t2057*t557 - t5456 + t5459 - t5462 + t5466 - t5468 | ^ Warning: ‘t557’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:365:41: 365 | t5562, t5564, t5565, t5568, t557, t5572, t5574, t5575, t5579, t558, t5581, t5585, t5590, & | ^ note: ‘t557’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2252:66: 2252 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 | ^ Warning: ‘t550’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:363:32: 363 | REAL(KIND=dp) :: t55, t550, t5503, t5507, t5509, t551, t5511, t5516, t5523, t5525, t5528, & | ^ note: ‘t550’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2312:55: 2312 | t5301 = 0.3333333336e0_dp*t55*t384*t4729 | ^ Warning: ‘t55’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:363:26: 363 | REAL(KIND=dp) :: t55, t550, t5503, t5507, t5509, t551, t5511, t5516, t5523, t5525, t5528, & | ^ note: ‘t55’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:929:31: 929 | t1071 = t45*t541 | ^ Warning: ‘t541’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:359:90: 359 | t5373, t5376, t5379, t5383, t5386, t5389, t5397, t5400, t5402, t5406, t5409, t541, t5412, & | ^ note: ‘t541’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1725:80: 1725 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 | ^ Warning: ‘t537’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:358:83: 358 | t5342, t5343, t5345, t5347, t5351, t5354, t5357, t5360, t5363, t5367, t537, t5370, t5371, & | ^ note: ‘t537’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1678:69: 1678 | *(t199)*(t2281) - 0.1851851853e0_dp*t508*t1201 | ^ Warning: ‘t534’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:357:97: 357 | t5311, t5314, t5317, t5320, t5323, t5326, t5329, t5330, t5333, t5335, t5338, t5339, t534, & | ^ note: ‘t534’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1691:34: 1691 | *t503*t2312 | ^ Warning: ‘t531’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:356:94: 356 | REAL(KIND=dp) :: t5291, t5294, t5295, t5298, t53, t530, t5301, t5303, t5305, t5308, t531, & | ^ note: ‘t531’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1691:34: 1691 | *t503*t2312 | ^ Warning: ‘t530’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:356:60: 356 | REAL(KIND=dp) :: t5291, t5294, t5295, t5298, t53, t530, t5301, t5303, t5305, t5308, t531, & | ^ note: ‘t530’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1242:51: 1242 | t1735 = 0.3703703705e-1_dp*t719*t527 | ^ Warning: ‘t527’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:355:33: 355 | t5256, t526, t5262, t527, t5270, t5271, t5276, t5280, t5281, t5284 | ^ note: ‘t527’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1700:64: 1700 | *t2622*t71 - 0.1666666668e0_dp*t1106*t886 | ^ Warning: ‘t526’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:355:20: 355 | t5256, t526, t5262, t527, t5270, t5271, t5276, t5280, t5281, t5284 | ^ note: ‘t526’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: ‘t520’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:354:46: 354 | t516, t5163, t517, t5170, t5174, t520, t5226, t5228, t5229, t5237, t5244, t5247, t5251, & | ^ note: ‘t520’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: ‘t517’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:354:26: 354 | t516, t5163, t517, t5170, t5174, t520, t5226, t5228, t5229, t5237, t5244, t5247, t5251, & | ^ note: ‘t517’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1954:37: 1954 | *t58*t3796*t71 | ^ Warning: ‘t516’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:354:13: 354 | t516, t5163, t517, t5170, t5174, t520, t5226, t5228, t5229, t5237, t5244, t5247, t5251, & | ^ note: ‘t516’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: ‘t515’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:353:95: 353 | t5106, t5108, t511, t5115, t5118, t512, t5122, t5123, t5126, t5139, t5143, t5147, t515, & | ^ note: ‘t515’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1691:34: 1691 | *t503*t2312 | ^ Warning: ‘t512’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:353:47: 353 | t5106, t5108, t511, t5115, t5118, t512, t5122, t5123, t5126, t5139, t5143, t5147, t515, & | ^ note: ‘t512’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:984:32: 984 | t1213 = t511*t225 | ^ Warning: ‘t511’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:353:27: 353 | t5106, t5108, t511, t5115, t5118, t512, t5122, t5123, t5126, t5139, t5143, t5147, t515, & | ^ note: ‘t511’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2608:52: 2608 | t6056 = 0.5555555558e-1_dp*t508*t5271 | ^ Warning: ‘t508’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:352:83: 352 | t5040, t5043, t5044, t5047, t5050, t5051, t5060, t5065, t5069, t5079, t508, t5083, t5087, & | ^ note: ‘t508’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2002:64: 2002 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 | ^ Warning: ‘t503’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:351:76: 351 | t5009, t5011, t5013, t5016, t5019, t5022, t5025, t5028, t5029, t503, t5032, t5035, t5036, & | ^ note: ‘t503’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:940:31: 940 | t1106 = t500*t67 | ^ Warning: ‘t500’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:350:65: 350 | t4952, t4955, t4958, t496, t498, t4994, t4995, t50, t500, t5001, t5002, t5005, t5008, & | ^ note: ‘t500’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1523:40: 1523 | *t1368*t166*t2160 | ^ Warning: ‘t50’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:350:59: 350 | t4952, t4955, t4958, t496, t498, t4994, t4995, t50, t500, t5001, t5002, t5005, t5008, & | ^ note: ‘t50’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1678:69: 1678 | *(t199)*(t2281) - 0.1851851853e0_dp*t508*t1201 | ^ Warning: ‘t498’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:350:40: 350 | t4952, t4955, t4958, t496, t498, t4994, t4995, t50, t500, t5001, t5002, t5005, t5008, & | ^ note: ‘t498’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: ‘t496’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:350:34: 350 | t4952, t4955, t4958, t496, t498, t4994, t4995, t50, t500, t5001, t5002, t5005, t5008, & | ^ note: ‘t496’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:569:30: 569 | t245*t17 | ^ Warning: ‘t49’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:347:74: 347 | t4881, t4884, t4887, t4889, t489, t4893, t4895, t4897, t4898, t49, t4901, t4904, t4905, & | ^ note: ‘t49’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1667:76: 1667 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 | ^ Warning: ‘t489’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:347:41: 347 | t4881, t4884, t4887, t4889, t489, t4893, t4895, t4897, t4898, t49, t4901, t4904, t4905, & | ^ note: ‘t489’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:586:38: 586 | t289 = my_rho*t48*omega | ^ Warning: ‘t48’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:345:19: 345 | t4797, t48, t4800, t4801, t4804, t4808, t4812, t4817, t4820, t4829, t4830, t4833, t4834, & | ^ note: ‘t48’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1658:33: 1658 | t1176*t804 | ^ Warning: ‘t479’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:344:75: 344 | t4769, t4770, t4771, t4772, t4776, t478, t4782, t4786, t4789, t479, t4790, t4793, t4796, & | ^ note: ‘t479’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2174:39: 2174 | t4895 = t478*t1500*t4729 | ^ Warning: ‘t478’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:344:48: 344 | t4769, t4770, t4771, t4772, t4776, t478, t4782, t4786, t4789, t479, t4790, t4793, t4796, & | ^ note: ‘t478’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1658:33: 1658 | t1176*t804 | ^ Warning: ‘t474’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:343:55: 343 | t4732, t4733, t4734, t4736, t4738, t4739, t474, t4743, t4744, t4748, t4760, t4764, t4768, & | ^ note: ‘t474’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2697:45: 2697 | *t4901 - t4907 + t4911 | ^ Warning: ‘t473’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:342:95: 342 | REAL(KIND=dp) :: t4708, t471, t4713, t4714, t4717, t472, t4721, t4725, t4726, t4729, t473, & | ^ note: ‘t473’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1286:32: 1286 | t1821 = t472*t262 | ^ Warning: ‘t472’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:342:61: 342 | REAL(KIND=dp) :: t4708, t471, t4713, t4714, t4717, t472, t4721, t4725, t4726, t4729, t473, & | ^ note: ‘t472’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2778:29: 2778 | *t6271 | ^ Warning: ‘t471’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:342:34: 342 | REAL(KIND=dp) :: t4708, t471, t4713, t4714, t4717, t472, t4721, t4725, t4726, t4729, t473, & | ^ note: ‘t471’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1017:40: 1017 | t1300 = 0.1e1_dp/t41/t470 | ^ Warning: ‘t470’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:341:45: 341 | t4627, t4657, t466, t4696, t47, t470, t4700, t4701, t4704, t4707 | ^ note: ‘t470’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:643:30: 643 | t399 = t47*t398 | ^ Warning: ‘t47’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:341:39: 341 | t4627, t4657, t466, t4696, t47, t470, t4700, t4701, t4704, t4707 | ^ note: ‘t47’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1594:104: 1594 | *t394) + 0.5000000001e0_dp*t165*t2720*t237 | ^ Warning: ‘t466’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:341:27: 341 | t4627, t4657, t466, t4696, t47, t470, t4700, t4701, t4704, t4707 | ^ note: ‘t466’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1609:40: 1609 | *t2763*t446*t2779 | ^ Warning: ‘t462’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:340:97: 340 | t4498, t45, t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, & | ^ note: ‘t462’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:713:98: 713 | t46*t541))*sx | ^ Warning: ‘t46’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:340:84: 340 | t4498, t45, t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, & | ^ note: ‘t46’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1523:40: 1523 | *t1368*t166*t2160 | ^ Warning: ‘t455’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:340:58: 340 | t4498, t45, t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, & | ^ note: ‘t455’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: ‘t451’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:340:38: 340 | t4498, t45, t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, & | ^ note: ‘t451’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1594:104: 1594 | *t394) + 0.5000000001e0_dp*t165*t2720*t237 | ^ Warning: ‘t450’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:340:25: 340 | t4498, t45, t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, & | ^ note: ‘t450’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1725:80: 1725 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 | ^ Warning: ‘t446’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:339:84: 339 | t4317, t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, & | ^ note: ‘t446’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2643:38: 2643 | t6144 = t445*t4512*t668 | ^ Warning: ‘t445’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:339:78: 339 | t4317, t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, & | ^ note: ‘t445’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1597:33: 1597 | t2763 = t1367*t444 | ^ Warning: ‘t444’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:339:72: 339 | t4317, t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, & | ^ note: ‘t444’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1725:80: 1725 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 | ^ Warning: ‘t437’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:339:40: 339 | t4317, t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, & | ^ note: ‘t437’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1646:57: 1646 | - 0.5000000001e0_dp*t429*t437*t914 | ^ Warning: ‘t433’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:339:20: 339 | t4317, t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, & | ^ note: ‘t433’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2098:96: 2098 | t3869 + t4657 + t4696) | ^ Warning: ‘t43’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:338:92: 338 | t4201, t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, & | ^ note: ‘t43’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2641:38: 2641 | t6138 = t429*t1928*t593 | ^ Warning: ‘t429’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:338:80: 338 | t4201, t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, & | ^ note: ‘t429’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1748:30: 1748 | t3305 = t4*t428 | ^ Warning: ‘t428’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:338:74: 338 | t4201, t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, & | ^ note: ‘t428’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2637:56: 2637 | t6126 = 0.1800000000e2_dp*t658*t4764*t425 | ^ Warning: ‘t425’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:338:40: 338 | t4201, t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, & | ^ note: ‘t425’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1646:57: 1646 | - 0.5000000001e0_dp*t429*t437*t914 | ^ Warning: ‘t424’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:338:34: 338 | t4201, t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, & | ^ note: ‘t424’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:636:31: 636 | t383 = t42*omega | ^ Warning: ‘t42’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:337:97: 337 | t4025, t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, & | ^ note: ‘t42’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1633:65: 1633 | *t2869 - 0.6000000000e1_dp*t405*t2873*t237 | ^ Warning: ‘t417’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:337:92: 337 | t4025, t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, & | ^ note: ‘t417’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1725:80: 1725 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 | ^ Warning: ‘t413’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:337:72: 337 | t4025, t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, & | ^ note: ‘t413’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:790:38: 790 | t747 = lambda*t41*omega | ^ Warning: ‘t41’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:337:52: 337 | t4025, t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, & | ^ note: ‘t41’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1633:65: 1633 | *t2869 - 0.6000000000e1_dp*t405*t2873*t237 | ^ Warning: ‘t406’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:337:33: 337 | t4025, t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, & | ^ note: ‘t406’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:819:35: 819 | *t49*t822*t14 | ^ Warning: ‘t405’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:337:27: 337 | t4025, t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, & | ^ note: ‘t405’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1621:39: 1621 | *t400*t401*t2230 | ^ Warning: ‘t401’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:336:82: 336 | t3940, t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, & | ^ note: ‘t401’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2449:38: 2449 | t5643 = t400*t3975*t561 | ^ Warning: ‘t400’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:336:76: 336 | t3940, t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, & | ^ note: ‘t400’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1648:41: 1648 | t2992 = 0.1e1_dp/t1140/t40 | ^ Warning: ‘t40’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:336:70: 336 | t3940, t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, & | ^ note: ‘t40’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1069:30: 1069 | t1409 = t4*t164 | ^ Warning: ‘t4’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:336:65: 336 | t3940, t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, & | ^ note: ‘t4’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1327:32: 1327 | t1912 = t399*t245 | ^ Warning: ‘t399’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:336:61: 336 | t3940, t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, & | ^ note: ‘t399’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1726:34: 1726 | t3278 = my_rho*t398 | ^ Warning: ‘t398’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:336:48: 336 | t3940, t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, & | ^ note: ‘t398’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1594:104: 1594 | *t394) + 0.5000000001e0_dp*t165*t2720*t237 | ^ Warning: ‘t394’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:335:94: 335 | REAL(KIND=dp) :: t387, t3871, t3875, t3892, t3918, t392, t3925, t393, t3933, t3939, t394, & | ^ note: ‘t394’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2051:58: 2051 | + 0.3333333334e0_dp*t165*t437*t1688 | ^ Warning: ‘t393’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:335:74: 335 | REAL(KIND=dp) :: t387, t3871, t3875, t3892, t3918, t392, t3925, t393, t3933, t3939, t394, & | ^ note: ‘t393’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1646:57: 1646 | - 0.5000000001e0_dp*t429*t437*t914 | ^ Warning: ‘t392’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:335:61: 335 | REAL(KIND=dp) :: t387, t3871, t3875, t3892, t3918, t392, t3925, t393, t3933, t3939, t394, & | ^ note: ‘t392’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1062:29: 1062 | *t1397 | ^ Warning: ‘t387’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:335:27: 335 | REAL(KIND=dp) :: t387, t3871, t3875, t3892, t3918, t392, t3925, t393, t3933, t3939, t394, & | ^ note: ‘t387’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1736:66: 1736 | *t1068 + 0.8333333340e-1_dp*t906*t384*t2160 | ^ Warning: ‘t384’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:334:33: 334 | t3826, t3827, t383, t384, t3842, t3849, t3853, t3861, t3865, t3869 | ^ note: ‘t384’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2327:51: 2327 | t5335 = 0.2222222224e0_dp*t383*t5281 | ^ Warning: ‘t383’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:334:27: 334 | t3826, t3827, t383, t384, t3842, t3849, t3853, t3861, t3865, t3869 | ^ note: ‘t383’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1062:29: 1062 | *t1397 | ^ Warning: ‘t380’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:333:97: 333 | t3682, t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, & | ^ note: ‘t380’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1736:66: 1736 | *t1068 + 0.8333333340e-1_dp*t906*t384*t2160 | ^ Warning: ‘t379’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:333:77: 333 | t3682, t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, & | ^ note: ‘t379’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2433:42: 2433 | t5602 = 0.40e1_dp*t624*t376 | ^ Warning: ‘t376’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:333:64: 333 | t3682, t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, & | ^ note: ‘t376’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1568:55: 1568 | 0.5866666667e2_dp*t962*t949*t375 | ^ Warning: ‘t375’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:333:51: 333 | t3682, t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, & | ^ note: ‘t375’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1200:48: 1200 | t1662 = 0.3200000000e2_dp*t7*t372 | ^ Warning: ‘t372’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:333:38: 333 | t3682, t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, & | ^ note: ‘t372’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1550:34: 1550 | *t2565*t796 | ^ Warning: ‘t371’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:333:25: 333 | t3682, t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, & | ^ note: ‘t371’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:718:61: 718 | t561 = 0.40e1_dp*t24*t37 - 0.20e1_dp*t102*t558 | ^ Warning: ‘t37’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:333:19: 333 | t3682, t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, & | ^ note: ‘t37’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1550:34: 1550 | *t2565*t796 | ^ Warning: ‘t368’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:332:92: 332 | t360, t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, & | ^ note: ‘t368’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:862:31: 862 | t942 = t367*t306 | ^ Warning: ‘t367’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:332:58: 332 | t360, t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, & | ^ note: ‘t367’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2392:38: 2392 | t5496 = t366*t368*t1681 | ^ Warning: ‘t366’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:332:45: 332 | t360, t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, & | ^ note: ‘t366’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1550:34: 1550 | *t2565*t796 | ^ Warning: ‘t365’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:332:39: 332 | t360, t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, & | ^ note: ‘t365’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1201:42: 1201 | t1664 = 0.60e1_dp*t550*t362 | ^ Warning: ‘t362’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:332:33: 332 | t360, t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, & | ^ note: ‘t362’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1550:34: 1550 | *t2565*t796 | ^ Warning: ‘t360’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:332:13: 332 | t360, t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, & | ^ note: ‘t360’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:559:30: 559 | t221 = t220*t36 | ^ Warning: ‘t36’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:331:94: 331 | t3546, t3547, t3552, t3553, t356, t3561, t3569, t357, t3575, t3576, t3580, t3581, t36, & | ^ note: ‘t36’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1667:76: 1667 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 | ^ Warning: ‘t357’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:331:61: 331 | t3546, t3547, t3552, t3553, t356, t3561, t3569, t357, t3575, t3576, t3580, t3581, t36, & | ^ note: ‘t357’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:905:35: 905 | t1002*my_rho | ^ Warning: ‘t356’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:331:41: 331 | t3546, t3547, t3552, t3553, t356, t3561, t3569, t357, t3575, t3576, t3580, t3581, t36, & | ^ note: ‘t356’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1197:51: 1197 | t1656 = 0.8000000000e1_dp*t1429*t352 | ^ Warning: ‘t352’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:330:73: 330 | t3497, t35, t350, t3501, t3505, t3507, t3512, t3513, t3514, t352, t3525, t3533, t3543, & | ^ note: ‘t352’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: 1850 | *t786*t1034*t1681 | ^ Warning: ‘t350’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:330:25: 330 | t3497, t35, t350, t3501, t3505, t3507, t3512, t3513, t3514, t352, t3525, t3533, t3543, & | ^ note: ‘t350’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1559:40: 1559 | t2585 = 0.1e1_dp/t972/t35 | ^ Warning: ‘t35’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:330:19: 330 | t3497, t35, t350, t3501, t3505, t3507, t3512, t3513, t3514, t352, t3525, t3533, t3543, & | ^ note: ‘t35’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2387:51: 2387 | t5484 = 0.1760000000e3_dp*t5460*t347 | ^ Warning: ‘t347’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:329:72: 329 | t3378, t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, & | ^ note: ‘t347’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1193:51: 1193 | t1647 = 0.5600000000e2_dp*t1645*t343 | ^ Warning: ‘t343’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:329:52: 329 | t3378, t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, & | ^ note: ‘t343’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: 1841 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: ‘t342’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:329:46: 329 | t3378, t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, & | ^ note: ‘t342’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1725:80: 1725 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 | ^ Warning: ‘t341’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:329:40: 329 | t3378, t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, & | ^ note: ‘t341’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t339’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:329:34: 329 | t3378, t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, & | ^ note: ‘t339’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1188:49: 1188 | t1638 = 0.1200000000e3_dp*t24*t336 | ^ Warning: ‘t336’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:328:76: 328 | REAL(KIND=dp) :: t3339, t3344, t3347, t3352, t3353, t3356, t3357, t336, t3362, t3363, t3366, & | ^ note: ‘t336’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1202:79: 1202 | t1667 = 0.28e2_dp/0.3e1_dp*t332 - 0.28e2_dp/0.3e1_dp*t987*my_rho | ^ Warning: ‘t332’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:327:80: 327 | t3268, t327, t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329 | ^ note: ‘t332’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1747:63: 1747 | e_rho_rho_rho(ii) = e_rho_rho_rho(ii) + t3291*sx | ^ Warning: ‘t3291’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:327:53: 327 | t3268, t327, t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329 | ^ note: ‘t3291’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1172:42: 1172 | t1615 = 0.80e1_dp*t112*t329 | ^ Warning: ‘t329’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:327:46: 327 | t3268, t327, t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329 | ^ note: ‘t329’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1568:55: 1568 | 0.5866666667e2_dp*t962*t949*t375 | ^ Warning: ‘t328’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:327:33: 327 | t3268, t327, t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329 | ^ note: ‘t328’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1881:32: 1881 | t3842 = t3278*t46 | ^ Warning: ‘t3278’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:327:27: 327 | t3268, t327, t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329 | ^ note: ‘t3278’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1558:85: 1558 | - 0.20e1_dp*t102*t105*t2569 - 0.6400000001e2_dp*t321*t953*t979 | ^ Warning: ‘t327’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:327:20: 327 | t3268, t327, t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329 | ^ note: ‘t327’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1932:32: 1932 | t4025 = t3262*t57 | ^ Warning: ‘t3262’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:85: 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & | ^ note: ‘t3262’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1161:34: 1161 | t1598 = t326*my_rho | ^ Warning: ‘t326’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:78: 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & | ^ note: ‘t326’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2061:71: 2061 | *t3507 - t3512)*t149*t160 | ^ Warning: ‘t3248’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:72: 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & | ^ note: ‘t3248’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2034:41: 2034 | *t1246*t3244*t1483 | ^ Warning: ‘t3244’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:65: 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & | ^ note: ‘t3244’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2420:51: 2420 | t5568 = 0.1066666667e2_dp*t1645*t322 | ^ Warning: ‘t322’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:51: 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & | ^ note: ‘t322’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2382:57: 2382 | t5472 = 0.3200000001e2_dp*t321*t2455*t5079 | ^ Warning: ‘t321’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:45: 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & | ^ note: ‘t321’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1159:43: 1159 | t1596 = 0.320e2_dp*t605*t318 | ^ Warning: ‘t318’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:32: 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & | ^ note: ‘t318’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1568:55: 1568 | 0.5866666667e2_dp*t962*t949*t375 | ^ Warning: ‘t317’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:26: 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & | ^ note: ‘t317’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1568:55: 1568 | 0.5866666667e2_dp*t962*t949*t375 | ^ Warning: ‘t316’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:20: 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & | ^ note: ‘t316’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2377:51: 2377 | t5462 = 0.1173333333e3_dp*t5460*t313 | ^ Warning: ‘t313’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:325:91: 325 | t3069, t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, & | ^ note: ‘t313’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: ‘t311’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:325:78: 325 | t3069, t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, & | ^ note: ‘t311’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:715:29: 715 | t551 = t27*t31 | ^ Warning: ‘t31’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:325:72: 325 | t3069, t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, & | ^ note: ‘t31’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2002:64: 2002 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 | ^ Warning: ‘t3097’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:325:60: 325 | t3069, t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, & | ^ note: ‘t3097’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:890:40: 890 | t1002 = 0.1e1_dp/t19/t309 | ^ Warning: ‘t309’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:325:46: 325 | t3069, t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, & | ^ note: ‘t309’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:900:31: 900 | t1033 = t308*t12 | ^ Warning: ‘t308’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:325:33: 325 | t3069, t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, & | ^ note: ‘t308’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2435:56: 2435 | t5607 = 0.5866666667e2_dp*t307*t949*t5069 | ^ Warning: ‘t307’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:325:20: 325 | t3069, t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, & | ^ note: ‘t307’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:858:31: 858 | t929 = t306*t311 | ^ Warning: ‘t306’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:92: 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & | ^ note: ‘t306’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1965:39: 1965 | *t478*t183*t3918 | ^ Warning: ‘t3030’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:86: 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & | ^ note: ‘t3030’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t302’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:72: 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & | ^ note: ‘t302’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1965:39: 1965 | *t478*t183*t3918 | ^ Warning: ‘t2998’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:66: 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & | ^ note: ‘t2998’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1965:39: 1965 | *t478*t183*t3918 | ^ Warning: ‘t2994’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:59: 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & | ^ note: ‘t2994’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2778:29: 2778 | *t6271 | ^ Warning: ‘t2992’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:52: 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & | ^ note: ‘t2992’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1149:49: 1149 | t1579 = 0.1173333333e3_dp*t24*t299 | ^ Warning: ‘t299’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:45: 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & | ^ note: ‘t299’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1160:30: 1160 | t1597 = t7*t298 | ^ Warning: ‘t298’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:39: 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & | ^ note: ‘t298’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1062:29: 1062 | *t1397 | ^ Warning: ‘t295’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:33: 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & | ^ note: ‘t295’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1744:85: 1744 | + t3288) | ^ Warning: ‘t294’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:27: 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & | ^ note: ‘t294’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2051:58: 2051 | + 0.3333333334e0_dp*t165*t437*t1688 | ^ Warning: ‘t2937’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:21: 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & | ^ note: ‘t2937’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1736:66: 1736 | *t1068 + 0.8333333340e-1_dp*t906*t384*t2160 | ^ Warning: ‘t290’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:323:94: 323 | t282, t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, & | ^ note: ‘t290’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2656:38: 2656 | t6181 = t289*t1564*t593 | ^ Warning: ‘t289’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:323:88: 323 | t282, t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, & | ^ note: ‘t289’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2343:39: 2343 | t5373 = t2885*t446*t5371 | ^ Warning: ‘t2885’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:323:82: 323 | t282, t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, & | ^ note: ‘t2885’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1923:34: 1923 | t1320*t1483 | ^ Warning: ‘t2873’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:323:68: 323 | t282, t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, & | ^ note: ‘t2873’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1066:96: 1066 | t804 - 0.4444444448e0_dp*t43*t894 + t8*t1401)*sx | ^ Warning: ‘t283’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:323:33: 323 | t282, t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, & | ^ note: ‘t283’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1910:40: 1910 | *t400*t1333*t1410 | ^ Warning: ‘t2823’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:323:27: 323 | t282, t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, & | ^ note: ‘t2823’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2709:36: 2709 | t5011 + t5001 | ^ Warning: ‘t2821’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:323:20: 323 | t282, t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, & | ^ note: ‘t2821’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1744:85: 1744 | + t3288) | ^ Warning: ‘t282’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:323:13: 323 | t282, t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, & | ^ note: ‘t282’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1910:40: 1910 | *t400*t1333*t1410 | ^ Warning: ‘t2808’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:322:87: 322 | t271, t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, & | ^ note: ‘t2808’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1725:80: 1725 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 | ^ Warning: ‘t278’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:322:73: 322 | t271, t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, & | ^ note: ‘t278’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2346:59: 2346 | t5383 = 0.4166666667e-1_dp*t2763*t1247*t5002 | ^ Warning: ‘t2763’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:322:60: 322 | t271, t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, & | ^ note: ‘t2763’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1691:34: 1691 | *t503*t2312 | ^ Warning: ‘t275’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:322:46: 322 | t271, t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, & | ^ note: ‘t275’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1808:33: 1808 | t3569 = t274*t1505 | ^ Warning: ‘t274’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:322:40: 322 | t271, t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, & | ^ note: ‘t274’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2034:41: 2034 | *t1246*t3244*t1483 | ^ Warning: ‘t2720’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:322:20: 322 | t271, t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, & | ^ note: ‘t2720’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1678:69: 1678 | *(t199)*(t2281) - 0.1851851853e0_dp*t508*t1201 | ^ Warning: ‘t271’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:322:13: 322 | t271, t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, & | ^ note: ‘t271’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2070:60: 2070 | + 0.2500000000e0_dp*t1981*t2707*t1410 | ^ Warning: ‘t2707’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:321:92: 321 | REAL(KIND=dp) :: t2631, t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, & | ^ note: ‘t2707’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:715:29: 715 | t551 = t27*t31 | ^ Warning: ‘t27’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:321:85: 321 | REAL(KIND=dp) :: t2631, t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, & | ^ note: ‘t27’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: ‘t268’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:321:80: 321 | REAL(KIND=dp) :: t2631, t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, & | ^ note: ‘t268’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: ‘t267’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:321:74: 321 | REAL(KIND=dp) :: t2631, t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, & | ^ note: ‘t267’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1678:69: 1678 | *(t199)*(t2281) - 0.1851851853e0_dp*t508*t1201 | ^ Warning: ‘t266’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:321:68: 321 | REAL(KIND=dp) :: t2631, t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, & | ^ note: ‘t266’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2079:39: 2079 | *t289*t294*t1553 | ^ Warning: ‘t2636’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:321:42: 321 | REAL(KIND=dp) :: t2631, t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, & | ^ note: ‘t2636’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2087:42: 2087 | *t83*t45*t3581*t140 | ^ Warning: ‘t2631’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:321:28: 321 | REAL(KIND=dp) :: t2631, t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, & | ^ note: ‘t2631’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1286:32: 1286 | t1821 = t472*t262 | ^ Warning: ‘t262’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:320:66: 320 | t2552, t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622 | ^ note: ‘t262’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2371:57: 2371 | t5449 = 0.1173333333e3_dp*t307*t2611*t5065 | ^ Warning: ‘t2611’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:320:60: 320 | t2552, t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622 | ^ note: ‘t2611’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2476:73: 2476 | t5716 = 0.1620000000e3_dp*t4994*t392*t4769*t1141*t26*t5713 | ^ Warning: ‘t26’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:320:47: 320 | t2552, t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622 | ^ note: ‘t26’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1858:33: 1858 | t3750 = t2585*t136 | ^ Warning: ‘t2585’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:320:42: 320 | t2552, t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622 | ^ note: ‘t2585’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2400:67: 2400 | *t5511 + 0.1200000000e3_dp*t1055*t2565*t4721 | ^ Warning: ‘t2565’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:320:21: 320 | t2552, t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622 | ^ note: ‘t2565’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1832:32: 1832 | t3668 = t2552*t23 | ^ Warning: ‘t2552’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:320:14: 320 | t2552, t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622 | ^ note: ‘t2552’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: 1841 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: ‘t2537’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:93: 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & | ^ note: ‘t2537’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2233:38: 2233 | + t5032 + t5035 | ^ Warning: ‘t250’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:86: 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & | ^ note: ‘t250’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:707:26: 707 | t537 | ^ Warning: ‘t25’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:80: 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & | ^ note: ‘t25’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2155:59: 2155 | - 0.2400000000e2_dp*t786/t2492*t1058 | ^ Warning: ‘t2492’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:75: 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & | ^ note: ‘t2492’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1523:40: 1523 | *t1368*t166*t2160 | ^ Warning: ‘t249’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:68: 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & | ^ note: ‘t249’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2252:66: 2252 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 | ^ Warning: ‘t2480’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:62: 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & | ^ note: ‘t2480’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1857:39: 1857 | *t321*t953*t1625 | ^ Warning: ‘t2468’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:55: 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & | ^ note: ‘t2468’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2382:57: 2382 | t5472 = 0.3200000001e2_dp*t321*t2455*t5079 | ^ Warning: ‘t2455’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:48: 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & | ^ note: ‘t2455’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1327:32: 1327 | t1912 = t399*t245 | ^ Warning: ‘t245’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:34: 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & | ^ note: ‘t245’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2079:39: 2079 | *t289*t294*t1553 | ^ Warning: ‘t2404’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:318:86: 318 | t2319, t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, & | ^ note: ‘t2404’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:615:30: 615 | t350 = t24*t225 | ^ Warning: ‘t24’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:318:79: 318 | t2319, t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, & | ^ note: ‘t24’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1744:85: 1744 | + t3288) | ^ Warning: ‘t237’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:318:53: 318 | t2319, t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, & | ^ note: ‘t237’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1152:44: 1152 | t1584 = 0.320e2_dp*t1582*t234 | ^ Warning: ‘t234’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:318:33: 318 | t2319, t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, & | ^ note: ‘t234’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1558:85: 1558 | - 0.20e1_dp*t102*t105*t2569 - 0.6400000001e2_dp*t321*t953*t979 | ^ Warning: ‘t233’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:318:27: 318 | t2319, t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, & | ^ note: ‘t233’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1083:53: 1083 | + 0.8000000000e1_dp*t366*t1440 | ^ Warning: ‘t230’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:317:53: 317 | t2287, t2292, t2295, t2296, t2299, t23, t230, t2300, t2304, t2307, t2308, t2311, t2312, & | ^ note: ‘t230’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1173:29: 1173 | t1616 = t7*t23 | ^ Warning: ‘t23’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:317:47: 317 | t2287, t2292, t2295, t2296, t2299, t23, t230, t2300, t2304, t2307, t2308, t2311, t2312, & | ^ note: ‘t23’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1650:31: 1650 | t2998 = t27*t225 | ^ Warning: ‘t225’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:315:92: 315 | t22, t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, & | ^ note: ‘t225’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:887:40: 887 | t995 = 0.1e1_dp/t787/t224 | ^ Warning: ‘t224’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:315:86: 315 | t22, t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, & | ^ note: ‘t224’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: 1850 | *t786*t1034*t1681 | ^ Warning: ‘t2220’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:315:59: 315 | t22, t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, & | ^ note: ‘t2220’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1087:28: 1087 | t1444 | ^ Warning: ‘t221’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:315:52: 315 | t22, t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, & | ^ note: ‘t221’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1550:34: 1550 | *t2565*t796 | ^ Warning: ‘t220’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:315:18: 315 | t22, t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, & | ^ note: ‘t220’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:605:30: 605 | t327 = t22*t326 | ^ Warning: ‘t22’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:315:12: 315 | t22, t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, & | ^ note: ‘t22’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:885:31: 885 | t987 = t219*t341 | ^ Warning: ‘t219’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:314:67: 314 | REAL(KIND=dp) :: t2169, t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, & | ^ note: ‘t219’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2252:66: 2252 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 | ^ Warning: ‘t2182’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:314:47: 314 | REAL(KIND=dp) :: t2169, t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, & | ^ note: ‘t2182’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1550:34: 1550 | *t2565*t796 | ^ Warning: ‘t218’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:314:40: 314 | REAL(KIND=dp) :: t2169, t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, & | ^ note: ‘t218’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2164:42: 2164 | t4864 = t217*t46*t1535*t561 | ^ Warning: ‘t217’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:314:34: 314 | REAL(KIND=dp) :: t2169, t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, & | ^ note: ‘t217’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2101:56: 2101 | t4704 = 0.3333333336e0_dp*t2147*t84*t4701 | ^ Warning: ‘t2147’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:313:62: 313 | t2126, t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160 | ^ note: ‘t2147’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2136:55: 2136 | t4789 = 0.4444444448e0_dp*t214*t46*t4786 | ^ Warning: ‘t214’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:313:48: 313 | t2126, t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160 | ^ note: ‘t214’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2738:79: 2738 | *t6181 - t6185 + t6189 - t6192 - 0.3333333336e0_dp*t6194 | ^ Warning: ‘t2139’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:313:42: 313 | t2126, t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160 | ^ note: ‘t2139’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2753:90: 2753 | t5418 + 0.1800000000e2_dp*t658*t575*t2074 + 0.1800000000e2_dp*t5421 | ^ Warning: ‘t2131’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:313:28: 313 | t2126, t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160 | ^ note: ‘t2131’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2790:82: 2790 | *t719*t2126 - t5973 + t5975 + 0.5999999999e1_dp*t2114*t6257 | ^ Warning: ‘t2126’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:313:14: 313 | t2126, t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160 | ^ note: ‘t2126’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2810:46: 2810 | *t60*t2124*t709 - t6044 | ^ Warning: ‘t2124’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:91: 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & | ^ note: ‘t2124’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2790:82: 2790 | *t719*t2126 - t5973 + t5975 + 0.5999999999e1_dp*t2114*t6257 | ^ Warning: ‘t2118’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:84: 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & | ^ note: ‘t2118’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2794:41: 2794 | *t5228*t2117*t2028 | ^ Warning: ‘t2117’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:77: 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & | ^ note: ‘t2117’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2790:82: 2790 | *t719*t2126 - t5973 + t5975 + 0.5999999999e1_dp*t2114*t6257 | ^ Warning: ‘t2114’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:70: 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & | ^ note: ‘t2114’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2810:46: 2810 | *t60*t2124*t709 - t6044 | ^ Warning: ‘t2113’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:63: 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & | ^ note: ‘t2113’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2800:60: 2800 | t6260 + 0.8999999998e1_dp*t5229*t2104 | ^ Warning: ‘t2104’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:49: 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & | ^ note: ‘t2104’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2778:29: 2778 | *t6271 | ^ Warning: ‘t2099’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:42: 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & | ^ note: ‘t2099’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2794:41: 2794 | *t5228*t2117*t2028 | ^ Warning: ‘t2098’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:35: 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & | ^ note: ‘t2098’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2790:82: 2790 | *t719*t2126 - t5973 + t5975 + 0.5999999999e1_dp*t2114*t6257 | ^ Warning: ‘t2095’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:28: 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & | ^ note: ‘t2095’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2820:76: 2820 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) | ^ Warning: ‘t2088’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:21: 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & | ^ note: ‘t2088’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2820:76: 2820 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) | ^ Warning: ‘t2082’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:97: 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & | ^ note: ‘t2082’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2768:38: 2768 | - t6090 + t6094 | ^ Warning: ‘t2081’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:90: 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & | ^ note: ‘t2081’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2820:76: 2820 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) | ^ Warning: ‘t2077’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:83: 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & | ^ note: ‘t2077’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2753:90: 2753 | t5418 + 0.1800000000e2_dp*t658*t575*t2074 + 0.1800000000e2_dp*t5421 | ^ Warning: ‘t2074’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:76: 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & | ^ note: ‘t2074’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1879:71: 1879 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 | ^ Warning: ‘t207’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:62: 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & | ^ note: ‘t207’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2739:33: 2739 | t6400 = t2061*t561 | ^ Warning: ‘t2061’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:56: 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & | ^ note: ‘t2061’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2731:78: 2731 | - t5595 + t5597 - t5600 - t5602 + t5604 + t5607 + t5610 | ^ Warning: ‘t2058’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:49: 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & | ^ note: ‘t2058’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2721:79: 2721 | *t327*t2057*t557 - t5456 + t5459 - t5462 + t5466 - t5468 | ^ Warning: ‘t2057’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:42: 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & | ^ note: ‘t2057’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2725:40: 2725 | *t1054*t640*t3679 | ^ Warning: ‘t2054’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:35: 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & | ^ note: ‘t2054’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2825:132: 2825 | + t6442 + t6451 + t6461 + t6479 + t6490 + t6499 + t6658) | ^ Warning: ‘t2050’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:28: 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & | ^ note: ‘t2050’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2829:73: 2829 | t43*t46*t6339 + t8*(t6344 + t6380 + t6389 + t6665) | ^ Warning: ‘t2046’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:21: 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & | ^ note: ‘t2046’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2764:63: 2764 | *t575*t161*t1447 + t5773 + t5776 + t5780 | ^ Warning: ‘t2042’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:14: 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & | ^ note: ‘t2042’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2820:76: 2820 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) | ^ Warning: ‘t2035’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:97: 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & | ^ note: ‘t2035’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2810:46: 2810 | *t60*t2124*t709 - t6044 | ^ Warning: ‘t2032’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:90: 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & | ^ note: ‘t2032’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2743:46: 2743 | *t27*t6291*t172 - t5397 | ^ Warning: ‘t2031’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:83: 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & | ^ note: ‘t2031’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:666:30: 666 | t466 = t27*t203 | ^ Warning: ‘t203’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:76: 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & | ^ note: ‘t203’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2794:41: 2794 | *t5228*t2117*t2028 | ^ Warning: ‘t2028’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:70: 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & | ^ note: ‘t2028’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2778:29: 2778 | *t6271 | ^ Warning: ‘t2027’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:63: 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & | ^ note: ‘t2027’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2233:38: 2233 | + t5032 + t5035 | ^ Warning: ‘t2022’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:56: 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & | ^ note: ‘t2022’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2716:54: 2716 | + 0.4500000000e1_dp*t2009*t4744 | ^ Warning: ‘t2018’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:49: 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & | ^ note: ‘t2018’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2716:54: 2716 | + 0.4500000000e1_dp*t2009*t4744 | ^ Warning: ‘t2014’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:42: 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & | ^ note: ‘t2014’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2716:54: 2716 | + 0.4500000000e1_dp*t2009*t4744 | ^ Warning: ‘t2013’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:35: 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & | ^ note: ‘t2013’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2716:54: 2716 | + 0.4500000000e1_dp*t2009*t4744 | ^ Warning: ‘t2009’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:28: 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & | ^ note: ‘t2009’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1895:32: 1895 | t3875 = t45*t2002 | ^ Warning: ‘t2002’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:14: 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & | ^ note: ‘t2002’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:777:87: 777 | t200 - 0.5555555558e-1_dp*t192*t729 - 0.5000000001e0_dp*t732*t709 | ^ Warning: ‘t200’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:309:80: 309 | t1980, t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, & | ^ note: ‘t200’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1355:31: 1355 | t1972 = t177*t20 | ^ Warning: ‘t20’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:309:74: 309 | t1980, t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, & | ^ note: ‘t20’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:693:31: 693 | t534 = t199*t267 | ^ Warning: ‘t199’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:309:48: 309 | t1980, t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, & | ^ note: ‘t199’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2478:56: 2478 | t5722 = 0.1111111111e0_dp*t165*t689*t1988 | ^ Warning: ‘t1988’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:309:42: 309 | t1980, t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, & | ^ note: ‘t1988’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2026:66: 2026 | *t1410 - 0.1666666667e0_dp*t429*t1392*t1410 | ^ Warning: ‘t1981’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:309:21: 309 | t1980, t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, & | ^ note: ‘t1981’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2357:43: 2357 | t5421 = t657*t1884*t59*t1975 | ^ Warning: ‘t1975’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:308:90: 308 | t1958, t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, & | ^ note: ‘t1975’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2756:70: 2756 | + t5619 + t5622 - t5625 - t5628 + t5631 + t5716 | ^ Warning: ‘t1974’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:308:83: 308 | t1958, t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, & | ^ note: ‘t1974’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2716:54: 2716 | + 0.4500000000e1_dp*t2009*t4744 | ^ Warning: ‘t1973’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:308:76: 308 | t1958, t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, & | ^ note: ‘t1973’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2631:63: 2631 | t6106 = 0.3600000000e2_dp*t1971*t1972*t1973*t672 | ^ Warning: ‘t1972’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:308:69: 308 | t1958, t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, & | ^ note: ‘t1972’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2631:63: 2631 | t6106 = 0.3600000000e2_dp*t1971*t1972*t1973*t672 | ^ Warning: ‘t1971’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:308:62: 308 | t1958, t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, & | ^ note: ‘t1971’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2621:57: 2621 | t6087 = 0.1666666667e0_dp*t429*t1966*t1410 | ^ Warning: ‘t1966’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:308:48: 308 | t1958, t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, & | ^ note: ‘t1966’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2305:68: 2305 | *t462*t4729 + 0.3333333334e0_dp*t55*t57*t5276 | ^ Warning: ‘t1962’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:308:34: 308 | t1958, t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, & | ^ note: ‘t1962’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:777:87: 777 | t200 - 0.5555555558e-1_dp*t192*t729 - 0.5000000001e0_dp*t732*t709 | ^ Warning: ‘t196’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:308:20: 308 | t1958, t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, & | ^ note: ‘t196’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:688:30: 688 | t520 = t195*t25 | ^ Warning: ‘t195’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:307:82: 307 | REAL(KIND=dp) :: t1928, t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, & | ^ note: ‘t195’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2042:44: 2042 | + (2*t147*t1284*t672) | ^ Warning: ‘t1940’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:307:62: 307 | REAL(KIND=dp) :: t1928, t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, & | ^ note: ‘t1940’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:690:36: 690 | t527 = t194*t187*t526 | ^ Warning: ‘t194’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:307:55: 307 | REAL(KIND=dp) :: t1928, t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, & | ^ note: ‘t194’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2034:41: 2034 | *t1246*t3244*t1483 | ^ Warning: ‘t1932’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:307:35: 307 | REAL(KIND=dp) :: t1928, t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, & | ^ note: ‘t1932’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2641:38: 2641 | t6138 = t429*t1928*t593 | ^ Warning: ‘t1928’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:307:28: 307 | REAL(KIND=dp) :: t1928, t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, & | ^ note: ‘t1928’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2642:38: 2642 | t6141 = t658*t575*t1925 | ^ Warning: ‘t1925’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:306:62: 306 | t1912, t1914, t1917, t192, t1920, t1923, t1924, t1925 | ^ note: ‘t1925’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2051:58: 2051 | + 0.3333333334e0_dp*t165*t437*t1688 | ^ Warning: ‘t1924’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:306:55: 306 | t1912, t1914, t1917, t192, t1920, t1923, t1924, t1925 | ^ note: ‘t1924’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2556:38: 2556 | t5938 = t192*t728*t1505 | ^ Warning: ‘t192’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:306:34: 306 | t1912, t1914, t1917, t192, t1920, t1923, t1924, t1925 | ^ note: ‘t192’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1923:34: 1923 | t1320*t1483 | ^ Warning: ‘t1912’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:306:14: 306 | t1912, t1914, t1917, t192, t1920, t1923, t1924, t1925 | ^ note: ‘t1912’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1923:34: 1923 | t1320*t1483 | ^ Warning: ‘t1902’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:305:81: 305 | t1884, t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, & | ^ note: ‘t1902’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2716:54: 2716 | + 0.4500000000e1_dp*t2009*t4744 | ^ Warning: ‘t19’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:305:67: 305 | t1884, t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, & | ^ note: ‘t19’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2456:58: 2456 | t5666 = 0.1125000000e2_dp*t1302*t1892*t1410 | ^ Warning: ‘t1892’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:305:48: 305 | t1884, t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, & | ^ note: ‘t1892’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:681:30: 681 | t503 = t189*t67 | ^ Warning: ‘t189’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:305:34: 305 | t1884, t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, & | ^ note: ‘t189’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2042:44: 2042 | + (2*t147*t1284*t672) | ^ Warning: ‘t1886’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:305:28: 305 | t1884, t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, & | ^ note: ‘t1886’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2709:36: 2709 | t5011 + t5001 | ^ Warning: ‘t1885’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:305:21: 305 | t1884, t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, & | ^ note: ‘t1885’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2357:43: 2357 | t5421 = t657*t1884*t59*t1975 | ^ Warning: ‘t1884’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:305:14: 305 | t1884, t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, & | ^ note: ‘t1884’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2070:60: 2070 | + 0.2500000000e0_dp*t1981*t2707*t1410 | ^ Warning: ‘t1875’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:304:83: 304 | t1852, t1854, t1858, t1861, t1864, t1865, t1868, t187, t1871, t1874, t1875, t1878, t1881, & | ^ note: ‘t1875’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:762:30: 762 | t707 = t187*t59 | ^ Warning: ‘t187’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:304:62: 304 | t1852, t1854, t1858, t1861, t1864, t1865, t1868, t187, t1871, t1874, t1875, t1878, t1881, & | ^ note: ‘t187’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2632:58: 2632 | t6109 = 0.1666666667e0_dp*t1246*t1962*t1865 | ^ Warning: ‘t1865’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:304:49: 304 | t1852, t1854, t1858, t1861, t1864, t1865, t1868, t187, t1871, t1874, t1875, t1878, t1881, & | ^ note: ‘t1865’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2035:32: 2035 | t4498 = t56*t1843 | ^ Warning: ‘t1843’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:303:90: 303 | t1824, t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, & | ^ note: ‘t1843’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2585:33: 2585 | t6006 = t719*t1838 | ^ Warning: ‘t1838’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:303:76: 303 | t1824, t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, & | ^ note: ‘t1838’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1947:70: 1947 | *t508*t1769 - 0.1111111112e0_dp*t192*t1837*t267 | ^ Warning: ‘t1837’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:303:69: 303 | t1824, t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, & | ^ note: ‘t1837’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2542:42: 2542 | t5908 = t1836*t59*t177*t710 | ^ Warning: ‘t1836’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:303:62: 303 | t1824, t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, & | ^ note: ‘t1836’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1667:76: 1667 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 | ^ Warning: ‘t183’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:303:41: 303 | t1824, t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, & | ^ note: ‘t183’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2504:40: 2504 | t5797 = t1373*t1962*t1829 | ^ Warning: ‘t1829’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:303:35: 303 | t1824, t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, & | ^ note: ‘t1829’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2350:57: 2350 | t5400 = 0.3333333334e0_dp*t445*t1962*t1825 | ^ Warning: ‘t1825’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:303:21: 303 | t1824, t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, & | ^ note: ‘t1825’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1975:29: 1975 | *t3382 | ^ Warning: ‘t1821’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:302:88: 302 | t1797, t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, & | ^ note: ‘t1821’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1667:76: 1667 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 | ^ Warning: ‘t182’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:302:81: 302 | t1797, t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, & | ^ note: ‘t182’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1965:39: 1965 | *t478*t183*t3918 | ^ Warning: ‘t1811’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:302:61: 302 | t1797, t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, & | ^ note: ‘t1811’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2508:58: 2508 | t5810 = 0.1080000000e3_dp*t1143*t1801*t1410 | ^ Warning: ‘t1801’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:302:33: 302 | t1797, t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, & | ^ note: ‘t1801’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2709:36: 2709 | t5011 + t5001 | ^ Warning: ‘t18’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:302:19: 302 | t1797, t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, & | ^ note: ‘t18’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2560:52: 2560 | t5949 = 0.8999999998e1_dp*t1795*t4909 | ^ Warning: ‘t1795’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:301:97: 301 | t1774, t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, & | ^ note: ‘t1795’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2568:34: 2568 | t5966 = t1785*t1790 | ^ Warning: ‘t1790’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:301:83: 301 | t1774, t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, & | ^ note: ‘t1790’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2568:34: 2568 | t5966 = t1785*t1790 | ^ Warning: ‘t1785’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:301:62: 301 | t1774, t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, & | ^ note: ‘t1785’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2615:51: 2615 | t6078 = 0.1111111112e0_dp*t719*t1782 | ^ Warning: ‘t1782’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:301:48: 301 | t1774, t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, & | ^ note: ‘t1782’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2584:38: 2584 | t6004 = t1709*t178*t710 | ^ Warning: ‘t178’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:301:41: 301 | t1774, t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, & | ^ note: ‘t178’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2586:52: 2586 | t6009 = 0.5000000001e0_dp*t1777*t4908 | ^ Warning: ‘t1777’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:301:28: 301 | t1774, t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, & | ^ note: ‘t1777’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2578:52: 2578 | t5985 = 0.5000000001e0_dp*t1774*t4908 | ^ Warning: ‘t1774’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:301:14: 301 | t1774, t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, & | ^ note: ‘t1774’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:763:31: 763 | t708 = t707*t177 | ^ Warning: ‘t177’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:300:89: 300 | REAL(KIND=dp) :: t1758, t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, & | ^ note: ‘t177’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2536:33: 2536 | t5885 = t719*t1769 | ^ Warning: ‘t1769’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:300:83: 300 | REAL(KIND=dp) :: t1758, t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, & | ^ note: ‘t1769’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2610:40: 2610 | t6060 = t1766*t5881*t4940 | ^ Warning: ‘t1766’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:300:69: 300 | REAL(KIND=dp) :: t1758, t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, & | ^ note: ‘t1766’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2603:52: 2603 | t6044 = 0.2000000002e1_dp*t1763*t5956 | ^ Warning: ‘t1763’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:300:55: 300 | REAL(KIND=dp) :: t1758, t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, & | ^ note: ‘t1763’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:950:30: 950 | t1140 = t176**2 | ^ Warning: ‘t176’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:300:34: 300 | REAL(KIND=dp) :: t1758, t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, & | ^ note: ‘t176’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2002:64: 2002 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 | ^ Warning: ‘t1755’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:299:70: 299 | t1737, t1740, t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757 | ^ note: ‘t1755’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2597:72: 2597 | *t6021 + t6025 - 0.5555555558e-1_dp*t58*t5613*t71 | ^ Warning: ‘t1748’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:299:49: 299 | t1737, t1740, t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757 | ^ note: ‘t1748’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2010:66: 2010 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 | ^ Warning: ‘t1745’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:299:42: 299 | t1737, t1740, t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757 | ^ note: ‘t1745’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2562:52: 2562 | t5954 = 0.8999999998e1_dp*t1741*t4909 | ^ Warning: ‘t1741’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:299:28: 299 | t1737, t1740, t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757 | ^ note: ‘t1741’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2554:57: 2554 | t5929 = 0.2250000000e2_dp*t1740*t471*t4905 | ^ Warning: ‘t1740’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:299:21: 299 | t1737, t1740, t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757 | ^ note: ‘t1740’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1996:67: 1996 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 | ^ Warning: ‘t1737’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:299:14: 299 | t1737, t1740, t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757 | ^ note: ‘t1737’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2003:32: 2003 | t4352 = t1731*t67 | ^ Warning: ‘t1731’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:298:90: 298 | t1715, t1717, t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, & | ^ note: ‘t1731’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2588:52: 2588 | t6019 = 0.7407407410e-1_dp*t719*t1726 | ^ Warning: ‘t1726’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:298:69: 298 | t1715, t1717, t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, & | ^ note: ‘t1726’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2620:37: 2620 | *t6075 - t6078 | ^ Warning: ‘t1722’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:298:55: 298 | t1715, t1717, t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, & | ^ note: ‘t1722’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2611:52: 2611 | t6063 = 0.1000000000e1_dp*t1720*t5956 | ^ Warning: ‘t1720’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:298:48: 298 | t1715, t1717, t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, & | ^ note: ‘t1720’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:782:70: 782 | *t165*t462*t561 + 0.3333333334e0_dp*t55*t57*t735 | ^ Warning: ‘t172’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:298:41: 298 | t1715, t1717, t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, & | ^ note: ‘t172’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2540:56: 2540 | t5902 = 0.1800000000e2_dp*t1718*t178*t710 | ^ Warning: ‘t1718’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:298:28: 298 | t1715, t1717, t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, & | ^ note: ‘t1718’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2567:34: 2567 | t5964 = t1715*t1525 | ^ Warning: ‘t1715’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:298:14: 298 | t1715, t1717, t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, & | ^ note: ‘t1715’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1996:67: 1996 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 | ^ Warning: ‘t1712’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:297:87: 297 | t1699, t17, t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, & | ^ note: ‘t1712’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:707:26: 707 | t537 | ^ Warning: ‘t171’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:297:80: 297 | t1699, t17, t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, & | ^ note: ‘t171’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2584:38: 2584 | t6004 = t1709*t178*t710 | ^ Warning: ‘t1709’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:297:74: 297 | t1699, t17, t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, & | ^ note: ‘t1709’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2087:42: 2087 | *t83*t45*t3581*t140 | ^ Warning: ‘t1706’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:297:60: 297 | t1699, t17, t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, & | ^ note: ‘t1706’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1893:39: 1893 | *t165*t3865*t237 | ^ Warning: ‘t1703’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:297:46: 297 | t1699, t17, t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, & | ^ note: ‘t1703’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1879:71: 1879 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 | ^ Warning: ‘t1700’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:297:32: 297 | t1699, t17, t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, & | ^ note: ‘t1700’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2483:61: 2483 | t5738 = 0.4444444445e0_dp*t170*t114*t4782*t451 | ^ Warning: ‘t170’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:297:25: 297 | t1699, t17, t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, & | ^ note: ‘t170’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:707:26: 707 | t537 | ^ Warning: ‘t17’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:297:19: 297 | t1699, t17, t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, & | ^ note: ‘t17’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2087:42: 2087 | *t83*t45*t3581*t140 | ^ Warning: ‘t1694’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:296:84: 296 | t1675, t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, & | ^ note: ‘t1694’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1879:71: 1879 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 | ^ Warning: ‘t1689’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:296:70: 296 | t1675, t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, & | ^ note: ‘t1689’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2654:37: 2654 | t6175 = t83*t597*t1688 | ^ Warning: ‘t1688’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:296:63: 296 | t1675, t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, & | ^ note: ‘t1688’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2419:33: 2419 | t5565 = t112*t1685 | ^ Warning: ‘t1685’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:296:56: 296 | t1675, t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, & | ^ note: ‘t1685’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2403:43: 2403 | t5528 = t102*t327*t1684*t557 | ^ Warning: ‘t1684’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:296:49: 296 | t1675, t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, & | ^ note: ‘t1684’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2392:38: 2392 | t5496 = t366*t368*t1681 | ^ Warning: ‘t1681’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:296:42: 296 | t1675, t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, & | ^ note: ‘t1681’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2397:38: 2397 | t5511 = t1680*t3673*t23 | ^ Warning: ‘t1680’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:296:35: 296 | t1675, t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, & | ^ note: ‘t1680’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2391:49: 2391 | t5494 = 0.6400000000e2_dp*t7*t1677 | ^ Warning: ‘t1677’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:296:21: 296 | t1675, t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, & | ^ note: ‘t1677’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2393:44: 2393 | t5499 = 0.120e2_dp*t550*t1669 | ^ Warning: ‘t1669’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:295:89: 295 | t1649, t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, & | ^ note: ‘t1669’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2395:52: 2395 | t5507 = 0.120e2_dp*t7*t640*t1667*t371 | ^ Warning: ‘t1667’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:295:82: 295 | t1649, t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, & | ^ note: ‘t1667’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:707:26: 707 | t537 | ^ Warning: ‘t166’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:295:54: 295 | t1649, t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, & | ^ note: ‘t166’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2389:52: 2389 | t5489 = 0.1600000000e2_dp*t1429*t1658 | ^ Warning: ‘t1658’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:295:48: 295 | t1649, t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, & | ^ note: ‘t1658’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2388:54: 2388 | t5487 = 0.2160000000e3_dp*t7*t995*t1652 | ^ Warning: ‘t1652’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:295:27: 295 | t1649, t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, & | ^ note: ‘t1652’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2499:57: 2499 | t5783 = 0.5555555557e-1_dp*t165*t5013*t433 | ^ Warning: ‘t165’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:295:20: 295 | t1649, t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, & | ^ note: ‘t165’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2161:56: 2161 | t102*t4838 - 0.20e1_dp*t102*t4850 | ^ Warning: ‘t1645’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:294:90: 294 | t1628, t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, & | ^ note: ‘t1645’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2386:49: 2386 | t5482 = 0.2160000000e3_dp*t7*t1642 | ^ Warning: ‘t1642’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:294:76: 294 | t1628, t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, & | ^ note: ‘t1642’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2252:66: 2252 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 | ^ Warning: ‘t1640’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:294:69: 294 | t1628, t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, & | ^ note: ‘t1640’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:660:31: 660 | t445 = t164*t444 | ^ Warning: ‘t164’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:294:62: 294 | t1628, t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, & | ^ note: ‘t164’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2405:44: 2405 | t5533 = 0.160e2_dp*t112*t1632 | ^ Warning: ‘t1632’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:294:35: 294 | t1628, t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, & | ^ note: ‘t1632’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t1631’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:294:28: 294 | t1628, t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, & | ^ note: ‘t1631’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2404:44: 2404 | t5531 = 0.160e2_dp*t112*t1626 | ^ Warning: ‘t1626’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:293:91: 293 | REAL(KIND=dp) :: t1615, t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, & | ^ note: ‘t1626’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1857:39: 1857 | *t321*t953*t1625 | ^ Warning: ‘t1625’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:293:84: 293 | REAL(KIND=dp) :: t1615, t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, & | ^ note: ‘t1625’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2407:44: 2407 | t5537 = 0.160e2_dp*t112*t1622 | ^ Warning: ‘t1622’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:293:70: 293 | REAL(KIND=dp) :: t1615, t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, & | ^ note: ‘t1622’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1857:39: 1857 | *t321*t953*t1625 | ^ Warning: ‘t1621’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:293:63: 293 | REAL(KIND=dp) :: t1615, t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, & | ^ note: ‘t1621’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2370:47: 2370 | t5446 = 0.480e2_dp*t24*t23*t1618 | ^ Warning: ‘t1618’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:293:49: 293 | REAL(KIND=dp) :: t1615, t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, & | ^ note: ‘t1618’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1857:39: 1857 | *t321*t953*t1625 | ^ Warning: ‘t1617’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:293:42: 293 | REAL(KIND=dp) :: t1615, t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, & | ^ note: ‘t1617’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1865:33: 1865 | *t339*t969 | ^ Warning: ‘t1616’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:293:35: 293 | REAL(KIND=dp) :: t1615, t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, & | ^ note: ‘t1616’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2402:51: 2402 | t5525 = 0.2133333334e2_dp*t339*t1611 | ^ Warning: ‘t1611’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:292:69: 292 | t1601, t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613 | ^ note: ‘t1611’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1441:46: 1441 | - t1994 + t1997 - t2000 | ^ Warning: ‘t161’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:292:55: 292 | t1601, t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613 | ^ note: ‘t161’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2383:51: 2383 | t5474 = 0.4266666668e2_dp*t339*t1608 | ^ Warning: ‘t1608’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:292:49: 292 | t1601, t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613 | ^ note: ‘t1608’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2372:44: 2372 | t5451 = 0.640e2_dp*t605*t1603 | ^ Warning: ‘t1603’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:292:28: 292 | t1601, t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613 | ^ note: ‘t1603’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1831:29: 1831 | *t3339 | ^ Warning: ‘t1602’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:292:21: 292 | t1601, t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613 | ^ note: ‘t1602’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:641:31: 641 | t394 = t393*t160 | ^ Warning: ‘t160’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:291:95: 291 | t1584, t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, & | ^ note: ‘t160’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1080:46: 1080 | t1439 = 0.1e1_dp/t787/t16*t1438 | ^ Warning: ‘t16’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:291:89: 291 | t1584, t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, & | ^ note: ‘t16’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2413:49: 2413 | t5551 = 0.1280e3_dp*t24*t298*t1599 | ^ Warning: ‘t1599’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:291:84: 291 | t1584, t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, & | ^ note: ‘t1599’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t1598’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:291:77: 291 | t1584, t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, & | ^ note: ‘t1598’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: ‘t1597’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:291:70: 291 | t1584, t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, & | ^ note: ‘t1597’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2416:52: 2416 | t5560 = 0.2346666666e3_dp*t1589*t1592 | ^ Warning: ‘t1592’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:291:49: 291 | t1584, t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, & | ^ note: ‘t1592’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1865:33: 1865 | *t339*t969 | ^ Warning: ‘t1589’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:291:35: 291 | t1584, t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, & | ^ note: ‘t1589’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2374:46: 2374 | t5456 = 0.1280e3_dp*t1582*t1426 | ^ Warning: ‘t1582’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:290:91: 290 | t1563, t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, & | ^ note: ‘t1582’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2087:42: 2087 | *t83*t45*t3581*t140 | ^ Warning: ‘t1575’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:290:63: 290 | t1563, t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, & | ^ note: ‘t1575’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2652:56: 2652 | t6170 = 0.3333333336e0_dp*t289*t597*t1571 | ^ Warning: ‘t1571’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:290:49: 290 | t1563, t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, & | ^ note: ‘t1571’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1893:39: 1893 | *t165*t3865*t237 | ^ Warning: ‘t1568’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:290:35: 290 | t1563, t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, & | ^ note: ‘t1568’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1893:39: 1893 | *t165*t3865*t237 | ^ Warning: ‘t1565’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:290:28: 290 | t1563, t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, & | ^ note: ‘t1565’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2656:38: 2656 | t6181 = t289*t1564*t593 | ^ Warning: ‘t1564’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:290:21: 290 | t1563, t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, & | ^ note: ‘t1564’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1633:65: 1633 | *t2869 - 0.6000000000e1_dp*t405*t2873*t237 | ^ Warning: ‘t156’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:289:89: 289 | t1541, t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, & | ^ note: ‘t156’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2666:56: 2666 | t6201 = 0.3333333336e0_dp*t289*t597*t1557 | ^ Warning: ‘t1557’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:289:83: 289 | t1541, t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, & | ^ note: ‘t1557’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2657:56: 2657 | t6185 = 0.3333333336e0_dp*t289*t597*t1553 | ^ Warning: ‘t1553’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:289:69: 289 | t1541, t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, & | ^ note: ‘t1553’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1621:39: 1621 | *t400*t401*t2230 | ^ Warning: ‘t155’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:289:55: 289 | t1541, t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, & | ^ note: ‘t155’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1879:71: 1879 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 | ^ Warning: ‘t1547’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:289:42: 289 | t1541, t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, & | ^ note: ‘t1547’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2079:39: 2079 | *t289*t294*t1553 | ^ Warning: ‘t1546’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:289:35: 289 | t1541, t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, & | ^ note: ‘t1546’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2098:96: 2098 | t3869 + t4657 + t4696) | ^ Warning: ‘t1536’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:288:91: 288 | t1513, t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, & | ^ note: ‘t1536’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2164:42: 2164 | t4864 = t217*t46*t1535*t561 | ^ Warning: ‘t1535’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:288:84: 288 | t1513, t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, & | ^ note: ‘t1535’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2070:60: 2070 | + 0.2500000000e0_dp*t1981*t2707*t1410 | ^ Warning: ‘t1531’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:288:77: 288 | t1513, t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, & | ^ note: ‘t1531’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2192:52: 2192 | t4932 = 0.5000000001e0_dp*t1528*t4908 | ^ Warning: ‘t1528’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:288:63: 288 | t1513, t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, & | ^ note: ‘t1528’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2200:33: 2200 | t4952 = t719*t1525 | ^ Warning: ‘t1525’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:288:56: 288 | t1513, t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, & | ^ note: ‘t1525’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2612:42: 2612 | t6066 = t1519*t705*t561*t65 | ^ Warning: ‘t1519’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:288:42: 288 | t1513, t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, & | ^ note: ‘t1519’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2589:39: 2589 | t6021 = t649*t1518*t1722 | ^ Warning: ‘t1518’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:288:35: 288 | t1513, t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, & | ^ note: ‘t1518’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2190:52: 2190 | t4925 = 0.5000000001e0_dp*t1513*t4908 | ^ Warning: ‘t1513’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:288:14: 288 | t1513, t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, & | ^ note: ‘t1513’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1983:41: 1983 | t192*t68*t4256*t65 | ^ Warning: ‘t1510’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:287:87: 287 | t1498, t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, & | ^ note: ‘t1510’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1395:80: 1395 | + t1482 + t1479 - t1489 + 0.3333333334e0_dp*t55*t57*t2042 | ^ Warning: ‘t151’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:287:80: 287 | t1498, t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, & | ^ note: ‘t151’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2184:52: 2184 | t4911 = 0.8999999998e1_dp*t1507*t4909 | ^ Warning: ‘t1507’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:287:67: 287 | t1498, t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, & | ^ note: ‘t1507’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2181:57: 2181 | t4907 = 0.2250000000e2_dp*t1506*t471*t4905 | ^ Warning: ‘t1506’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:287:60: 287 | t1498, t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, & | ^ note: ‘t1506’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2556:38: 2556 | t5938 = t192*t728*t1505 | ^ Warning: ‘t1505’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:287:53: 287 | t1498, t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, & | ^ note: ‘t1505’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2606:37: 2606 | t6052 = t1504*t561*t65 | ^ Warning: ‘t1504’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:287:46: 287 | t1498, t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, & | ^ note: ‘t1504’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2174:39: 2174 | t4895 = t478*t1500*t4729 | ^ Warning: ‘t1500’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:287:32: 287 | t1498, t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, & | ^ note: ‘t1500’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1744:85: 1744 | + t3288) | ^ Warning: ‘t150’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:287:25: 287 | t1498, t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, & | ^ note: ‘t150’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2171:57: 2171 | t4887 = 0.1800000000e2_dp*t473*t1493*t4729 | ^ Warning: ‘t1493’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:286:90: 286 | REAL(KIND=dp) :: t1471, t1476, t1479, t1482, t1483, t1485, t1489, t149, t1492, t1493, t1496, & | ^ note: ‘t1493’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:570:31: 570 | t250 = t149*t249 | ^ Warning: ‘t149’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:286:76: 286 | REAL(KIND=dp) :: t1471, t1476, t1479, t1482, t1483, t1485, t1489, t149, t1492, t1493, t1496, & | ^ note: ‘t149’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2633:59: 2633 | t6112 = 0.5555555556e-1_dp*t1246*t4553*t1483 | ^ Warning: ‘t1483’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:286:56: 286 | REAL(KIND=dp) :: t1471, t1476, t1479, t1482, t1483, t1485, t1489, t149, t1492, t1493, t1496, & | ^ note: ‘t1483’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2233:38: 2233 | + t5032 + t5035 | ^ Warning: ‘t1471’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:286:28: 286 | REAL(KIND=dp) :: t1471, t1476, t1479, t1482, t1483, t1485, t1489, t149, t1492, t1493, t1496, & | ^ note: ‘t1471’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1783:38: 1783 | t165*t171*t3449 | ^ Warning: ‘t1470’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:285:74: 285 | t1444, t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470 | ^ note: ‘t1470’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2233:38: 2233 | + t5032 + t5035 | ^ Warning: ‘t1466’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:285:61: 285 | t1444, t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470 | ^ note: ‘t1466’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2233:38: 2233 | + t5032 + t5035 | ^ Warning: ‘t1459’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:285:48: 285 | t1444, t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470 | ^ note: ‘t1459’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2786:32: 2786 | t6557 = t1447*t59 | ^ Warning: ‘t1447’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:285:21: 285 | t1444, t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470 | ^ note: ‘t1447’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2406:45: 2406 | t5535 = 0.640e2_dp*t1582*t1444 | ^ Warning: ‘t1444’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:285:14: 285 | t1444, t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470 | ^ note: ‘t1444’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2425:53: 2425 | t5579 = 0.80e1_dp*t102*t327*t645*t1443 | ^ Warning: ‘t1443’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:97: 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & | ^ note: ‘t1443’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2155:59: 2155 | - 0.2400000000e2_dp*t786/t2492*t1058 | ^ Warning: ‘t1440’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:90: 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & | ^ note: ‘t1440’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2079:39: 2079 | *t289*t294*t1553 | ^ Warning: ‘t144’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:83: 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & | ^ note: ‘t144’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1842:34: 1842 | t3679 = t2565*t1439 | ^ Warning: ‘t1439’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:77: 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & | ^ note: ‘t1439’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2252:66: 2252 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 | ^ Warning: ‘t1438’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:70: 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & | ^ note: ‘t1438’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: 1850 | *t786*t1034*t1681 | ^ Warning: ‘t1429’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:56: 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & | ^ note: ‘t1429’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2374:46: 2374 | t5456 = 0.1280e3_dp*t1582*t1426 | ^ Warning: ‘t1426’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:49: 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & | ^ note: ‘t1426’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2384:55: 2384 | t5478 = 0.240e2_dp*t1616*t973*t645*t1425 | ^ Warning: ‘t1425’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:42: 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & | ^ note: ‘t1425’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2379:51: 2379 | t5468 = 0.2346666666e3_dp*t605*t1420 | ^ Warning: ‘t1420’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:35: 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & | ^ note: ‘t1420’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2098:96: 2098 | t3869 + t4657 + t4696) | ^ Warning: ‘t1411’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:14: 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & | ^ note: ‘t1411’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2644:58: 2644 | t6155 = 0.2500000000e0_dp*t1981*t4032*t1410 | ^ Warning: ‘t1410’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:283:94: 283 | t1387, t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, & | ^ note: ‘t1410’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:713:98: 713 | t46*t541))*sx | ^ Warning: ‘t141’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:283:87: 283 | t1387, t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, & | ^ note: ‘t141’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2098:96: 2098 | t3869 + t4657 + t4696) | ^ Warning: ‘t1409’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:283:81: 283 | t1387, t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, & | ^ note: ‘t1409’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:782:70: 782 | *t165*t462*t561 + 0.3333333334e0_dp*t55*t57*t735 | ^ Warning: ‘t140’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:283:53: 283 | t1387, t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, & | ^ note: ‘t140’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1725:80: 1725 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 | ^ Warning: ‘t14’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:283:47: 283 | t1387, t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, & | ^ note: ‘t14’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2441:57: 2441 | t5622 = 0.1666666667e0_dp*t165*t1392*t4729 | ^ Warning: ‘t1392’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:283:28: 283 | t1387, t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, & | ^ note: ‘t1392’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2042:44: 2042 | + (2*t147*t1284*t672) | ^ Warning: ‘t1388’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:283:21: 283 | t1387, t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, & | ^ note: ‘t1388’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2070:60: 2070 | + 0.2500000000e0_dp*t1981*t2707*t1410 | ^ Warning: ‘t1387’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:283:14: 283 | t1387, t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, & | ^ note: ‘t1387’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2034:41: 2034 | *t1246*t3244*t1483 | ^ Warning: ‘t1377’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:95: 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & | ^ note: ‘t1377’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2366:39: 2366 | t5432 = t1373*t446*t5430 | ^ Warning: ‘t1373’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:88: 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & | ^ note: ‘t1373’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2259:34: 2259 | *t105*t5118 | ^ Warning: ‘t137’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:74: 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & | ^ note: ‘t137’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1783:38: 1783 | t165*t171*t3449 | ^ Warning: ‘t1368’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:68: 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & | ^ note: ‘t1368’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2051:58: 2051 | + 0.3333333334e0_dp*t165*t437*t1688 | ^ Warning: ‘t1360’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:54: 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & | ^ note: ‘t1360’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:606:31: 606 | t328 = t136*t233 | ^ Warning: ‘t136’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:47: 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & | ^ note: ‘t136’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2026:66: 2026 | *t1410 - 0.1666666667e0_dp*t429*t1392*t1410 | ^ Warning: ‘t1348’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:41: 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & | ^ note: ‘t1348’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1910:40: 1910 | *t400*t1333*t1410 | ^ Warning: ‘t1340’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:27: 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & | ^ note: ‘t1340’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2448:57: 2448 | t5641 = 0.1500000000e1_dp*t405*t1333*t4729 | ^ Warning: ‘t1333’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:20: 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & | ^ note: ‘t1333’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:745:73: 745 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 | ^ Warning: ‘t133’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:13: 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & | ^ note: ‘t133’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1923:34: 1923 | t1320*t1483 | ^ Warning: ‘t1320’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:93: 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & | ^ note: ‘t1320’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:745:73: 745 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 | ^ Warning: ‘t132’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:86: 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & | ^ note: ‘t132’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1923:34: 1923 | t1320*t1483 | ^ Warning: ‘t1316’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:80: 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & | ^ note: ‘t1316’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1536:43: 1536 | t2565 = t126/t131/t1056/t130 | ^ Warning: ‘t131’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:73: 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & | ^ note: ‘t131’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2459:57: 2459 | t5670 = 0.2250000000e1_dp*t400*t1309*t4729 | ^ Warning: ‘t1309’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:67: 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & | ^ note: ‘t1309’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2463:57: 2463 | t5679 = 0.1875000000e1_dp*t1302*t406*t5002 | ^ Warning: ‘t1302’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:60: 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & | ^ note: ‘t1302’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1900:33: 1900 | t3939 = t1301*t245 | ^ Warning: ‘t1301’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:53: 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & | ^ note: ‘t1301’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2716:54: 2716 | + 0.4500000000e1_dp*t2009*t4744 | ^ Warning: ‘t1300’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:46: 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & | ^ note: ‘t1300’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1536:43: 1536 | t2565 = t126/t131/t1056/t130 | ^ Warning: ‘t130’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:39: 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & | ^ note: ‘t130’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:808:44: 808 | t796 = 0.1e1_dp/t787/t13*t795 | ^ Warning: ‘t13’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:33: 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & | ^ note: ‘t13’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2364:57: 2364 | t5429 = 0.1666666667e0_dp*t445*t1292*t5143 | ^ Warning: ‘t1292’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:28: 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & | ^ note: ‘t1292’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2042:44: 2042 | + (2*t147*t1284*t672) | ^ Warning: ‘t1284’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:14: 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & | ^ note: ‘t1284’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2019:39: 2019 | *t429*t1928*t290 | ^ Warning: ‘t1283’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:96: 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & | ^ note: ‘t1283’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2061:71: 2061 | *t3507 - t3512)*t149*t160 | ^ Warning: ‘t1275’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:89: 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & | ^ note: ‘t1275’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2026:66: 2026 | *t1410 - 0.1666666667e0_dp*t429*t1392*t1410 | ^ Warning: ‘t1264’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:75: 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & | ^ note: ‘t1264’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:745:73: 745 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 | ^ Warning: ‘t126’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:68: 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & | ^ note: ‘t126’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2497:59: 2497 | t5776 = 0.2777777778e-1_dp*t1246*t1247*t5009 | ^ Warning: ‘t1247’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:55: 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & | ^ note: ‘t1247’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2497:59: 2497 | t5776 = 0.2777777778e-1_dp*t1246*t1247*t5009 | ^ Warning: ‘t1246’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:48: 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & | ^ note: ‘t1246’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2010:66: 2010 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 | ^ Warning: ‘t1235’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:27: 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & | ^ note: ‘t1235’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1667:76: 1667 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 | ^ Warning: ‘t123’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:20: 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & | ^ note: ‘t123’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1990:66: 1990 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 | ^ Warning: ‘t1224’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:14: 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & | ^ note: ‘t1224’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1996:67: 1996 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 | ^ Warning: ‘t1221’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:95: 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & | ^ note: ‘t1221’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:619:81: 619 | t360 = 0.28e2_dp/0.3e1_dp*t122*t114 - 0.28e2_dp/0.3e1_dp*t356*t357 | ^ Warning: ‘t122’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:88: 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & | ^ note: ‘t122’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2002:64: 2002 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 | ^ Warning: ‘t1216’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:82: 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & | ^ note: ‘t1216’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1983:41: 1983 | t192*t68*t4256*t65 | ^ Warning: ‘t1213’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:75: 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & | ^ note: ‘t1213’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1954:37: 1954 | *t58*t3796*t71 | ^ Warning: ‘t1207’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:61: 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & | ^ note: ‘t1207’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1996:67: 1996 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 | ^ Warning: ‘t1201’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:47: 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & | ^ note: ‘t1201’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1990:66: 1990 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 | ^ Warning: ‘t1200’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:40: 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & | ^ note: ‘t1200’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1803:35: 1803 | t3546 = 0.1e1_dp/t12 | ^ Warning: ‘t12’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:33: 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & | ^ note: ‘t12’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2010:66: 2010 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 | ^ Warning: ‘t1194’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:28: 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & | ^ note: ‘t1194’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1940:66: 1940 | *t1722 + 0.3703703706e0_dp*t1193*t1505*t451 | ^ Warning: ‘t1193’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:278:69: 278 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193 | ^ note: ‘t1193’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2010:66: 2010 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 | ^ Warning: ‘t1192’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:278:62: 278 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193 | ^ note: ‘t1192’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: 1841 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: ‘t119’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:278:48: 278 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193 | ^ note: ‘t119’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2010:66: 2010 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 | ^ Warning: ‘t1189’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:278:42: 278 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193 | ^ note: ‘t1189’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1975:29: 1975 | *t3382 | ^ Warning: ‘t1176’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:278:35: 278 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193 | ^ note: ‘t1176’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2034:41: 2034 | *t1246*t3244*t1483 | ^ Warning: ‘t1172’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:278:28: 278 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193 | ^ note: ‘t1172’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2034:41: 2034 | *t1246*t3244*t1483 | ^ Warning: ‘t1168’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:278:21: 278 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193 | ^ note: ‘t1168’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1965:39: 1965 | *t478*t183*t3918 | ^ Warning: ‘t1161’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:278:14: 278 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193 | ^ note: ‘t1161’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:745:73: 745 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 | ^ Warning: ‘t116’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:95: 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & | ^ note: ‘t116’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1975:29: 1975 | *t3382 | ^ Warning: ‘t1157’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:89: 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & | ^ note: ‘t1157’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2528:57: 2528 | t5864 = 0.1800000000e2_dp*t473*t1150*t4729 | ^ Warning: ‘t1150’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:82: 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & | ^ note: ‘t1150’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1187:50: 1187 | t1636 = 0.5600000000e2_dp*t624*t115 | ^ Warning: ‘t115’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:75: 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & | ^ note: ‘t115’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2505:57: 2505 | t5801 = 0.3600000000e2_dp*t1143*t479*t5002 | ^ Warning: ‘t1143’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:69: 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & | ^ note: ‘t1143’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1966:33: 1966 | t4230 = t1142*t262 | ^ Warning: ‘t1142’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:62: 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & | ^ note: ‘t1142’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2613:63: 2613 | t6074 = 0.8099999996e2_dp*t496*t4769*t1141*t4915 | ^ Warning: ‘t1141’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:55: 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & | ^ note: ‘t1141’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:619:81: 619 | t360 = 0.28e2_dp/0.3e1_dp*t122*t114 - 0.28e2_dp/0.3e1_dp*t356*t357 | ^ Warning: ‘t114’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:41: 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & | ^ note: ‘t114’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1990:66: 1990 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 | ^ Warning: ‘t1137’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:35: 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & | ^ note: ‘t1137’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1990:66: 1990 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 | ^ Warning: ‘t1134’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:28: 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & | ^ note: ‘t1134’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2002:64: 2002 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 | ^ Warning: ‘t1129’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:21: 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & | ^ note: ‘t1129’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1954:37: 1954 | *t58*t3796*t71 | ^ Warning: ‘t1126’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:14: 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & | ^ note: ‘t1126’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1996:67: 1996 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 | ^ Warning: ‘t1125’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:95: 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ note: ‘t1125’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1990:66: 1990 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 | ^ Warning: ‘t1122’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:88: 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ note: ‘t1122’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2419:33: 2419 | t5565 = t112*t1685 | ^ Warning: ‘t112’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:81: 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ note: ‘t112’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1996:67: 1996 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 | ^ Warning: ‘t1119’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:75: 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ note: ‘t1119’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1954:37: 1954 | *t58*t3796*t71 | ^ Warning: ‘t1111’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:68: 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ note: ‘t1111’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2002:64: 2002 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 | ^ Warning: ‘t1109’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:61: 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ note: ‘t1109’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1940:66: 1940 | *t1722 + 0.3703703706e0_dp*t1193*t1505*t451 | ^ Warning: ‘t1106’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:54: 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ note: ‘t1106’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1983:41: 1983 | t192*t68*t4256*t65 | ^ Warning: ‘t1101’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:47: 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ note: ‘t1101’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2070:60: 2070 | + 0.2500000000e0_dp*t1981*t2707*t1410 | ^ Warning: ‘t1100’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:40: 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ note: ‘t1100’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:608:30: 608 | t332 = t11*t114 | ^ Warning: ‘t11’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:33: 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ note: ‘t11’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1983:41: 1983 | t192*t68*t4256*t65 | ^ Warning: ‘t1097’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:21: 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ note: ‘t1097’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2070:60: 2070 | + 0.2500000000e0_dp*t1981*t2707*t1410 | ^ Warning: ‘t1093’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:14: 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ note: ‘t1093’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2034:41: 2034 | *t1246*t3244*t1483 | ^ Warning: ‘t1085’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:275:89: 275 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & | ^ note: ‘t1085’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:740:45: 740 | t635 = -4*t108 + 4*t332*my_rho | ^ Warning: ‘t108’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:275:75: 275 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & | ^ note: ‘t108’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2318:57: 2318 | t5311 = 0.1666666668e0_dp*t289*t1071*t4701 | ^ Warning: ‘t1071’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:275:55: 275 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & | ^ note: ‘t1071’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:745:73: 745 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 | ^ Warning: ‘t107’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:275:48: 275 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & | ^ note: ‘t107’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2053:33: 2053 | t4575 = t1067*t561 | ^ Warning: ‘t1067’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:275:35: 275 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & | ^ note: ‘t1067’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1831:29: 1831 | *t3339 | ^ Warning: ‘t1064’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:275:28: 275 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & | ^ note: ‘t1064’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1857:39: 1857 | *t321*t953*t1625 | ^ Warning: ‘t1063’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:275:21: 275 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & | ^ note: ‘t1063’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2725:40: 2725 | *t1054*t640*t3679 | ^ Warning: ‘t1060’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:275:14: 275 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & | ^ note: ‘t1060’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1461:31: 1461 | t2204 = t10*t106 | ^ Warning: ‘t106’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:95: 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & | ^ note: ‘t106’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2155:59: 2155 | - 0.2400000000e2_dp*t786/t2492*t1058 | ^ Warning: ‘t1058’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:82: 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & | ^ note: ‘t1058’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2400:67: 2400 | *t5511 + 0.1200000000e3_dp*t1055*t2565*t4721 | ^ Warning: ‘t1055’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:68: 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & | ^ note: ‘t1055’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2725:40: 2725 | *t1054*t640*t3679 | ^ Warning: ‘t1054’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:61: 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & | ^ note: ‘t1054’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: 1850 | *t786*t1034*t1681 | ^ Warning: ‘t1050’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:54: 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & | ^ note: ‘t1050’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:565:31: 565 | t234 = t105*t233 | ^ Warning: ‘t105’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:47: 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & | ^ note: ‘t105’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: 1841 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: ‘t1046’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:41: 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & | ^ note: ‘t1046’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: 1841 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: ‘t1044’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:34: 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & | ^ note: ‘t1044’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:599:30: 599 | t316 = t97*t104 | ^ Warning: ‘t104’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:20: 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & | ^ note: ‘t104’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: 1850 | *t786*t1034*t1681 | ^ Warning: ‘t1036’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:14: 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & | ^ note: ‘t1036’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: 1850 | *t786*t1034*t1681 | ^ Warning: ‘t1034’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:96: 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ note: ‘t1034’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: 1850 | *t786*t1034*t1681 | ^ Warning: ‘t1030’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:82: 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ note: ‘t1030’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:876:29: 876 | t972 = t103**2 | ^ Warning: ‘t103’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:75: 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ note: ‘t103’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: 1850 | *t786*t1034*t1681 | ^ Warning: ‘t1026’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:69: 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ note: ‘t1026’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: 1850 | *t786*t1034*t1681 | ^ Warning: ‘t1024’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:62: 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ note: ‘t1024’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: 1850 | *t786*t1034*t1681 | ^ Warning: ‘t1021’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:55: 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ note: ‘t1021’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2403:43: 2403 | t5528 = t102*t327*t1684*t557 | ^ Warning: ‘t102’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:48: 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ note: ‘t102’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1764:32: 1764 | t12*t1058 | ^ Warning: ‘t1014’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:35: 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ note: ‘t1014’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: 1850 | *t786*t1034*t1681 | ^ Warning: ‘t1012’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:28: 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ note: ‘t1012’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: 1850 | *t786*t1034*t1681 | ^ Warning: ‘t1008’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:21: 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ note: ‘t1008’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: 1841 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: ‘t1004’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:14: 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ note: ‘t1004’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1831:29: 1831 | *t3339 | ^ Warning: ‘t1000’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:272:90: 272 | REAL(KIND=dp) :: Cx, epsilon_rho43, my_epsilon_rho, my_ndrho, my_rho, t1, t10, t1000, t1002, & | ^ note: ‘t1000’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:895:50: 895 | t1019 = 0.1e1_dp/t19/t1014*t787*t10 | ^ Warning: ‘t10’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:272:83: 272 | REAL(KIND=dp) :: Cx, epsilon_rho43, my_epsilon_rho, my_ndrho, my_rho, t1, t10, t1000, t1002, & | ^ note: ‘t10’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_xbecke88_lr_adiabatic.mod' due to: xc_xbecke88_lr_adiabatic.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_array_utils.mod mathconstants.mod bibliography.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_xalpha.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xalpha.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod xc_functionals_utilities.mod kinds.mod cp_array_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xalpha.F xc_xalpha.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:59:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xalpha.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xalpha.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_xalpha.mod' due to: xc_xalpha.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xalpha.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod xc_functionals_utilities.mod kinds.mod cp_array_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_tpss.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_tpss.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_log_handling.mod mathconstants.mod bibliography.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_tpss.F xc_tpss.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:59:28 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_tpss.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_tpss.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_tpss.mod' due to: xc_tpss.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_tpss.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_log_handling.mod mathconstants.mod bibliography.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_xwpbe.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod mathlib.mod kinds.mod mathconstants.mod bibliography.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F xc_xwpbe.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:59:29 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xwpbe.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xwpbe.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5635:90: 5635 | 1.0_dp/Q*(dQrho*dQndrho + d2Qrhondrho) + 1.0_dp/(Q*Q)*dQrho*dQndrho | ^ Warning: ‘dqrho’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:983:76: 983 | REAL(KIND=dp) :: d2Qndrhondrho, d2Qrhondrho, d2Qrhorho, dQndrho, dQrho, Q, t1, t10, t100, & | ^ note: ‘dqrho’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5671:94: 5671 | 1.0_dp/(Q*Q)*(-Q*dQndrho*dQndrho - Q*d2Qndrhondrho + dQndrho*dQndrho) | ^ Warning: ‘dqndrho’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:983:69: 983 | REAL(KIND=dp) :: d2Qndrhondrho, d2Qrhondrho, d2Qrhorho, dQndrho, dQrho, Q, t1, t10, t100, & | ^ note: ‘dqndrho’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1416:88: 1416 | e_ndrho_rho = e_ndrho_rho + (-0.4e1_dp/0.3e1_dp*t235*t408 - t76*t1073*Clda)*sx0 | ^ Warning: ‘t408’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: 1438 | + t403*t1066 + t403*t1069) | ^ Warning: ‘t403’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: Warning: ‘t402’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: Warning: ‘t401’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: 1429 | *t114*t820*t1076 - t113*t114*t321*t1101 | ^ Warning: ‘t399’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: Warning: ‘t398’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: Warning: ‘t396’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: Warning: ‘t395’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: Warning: ‘t393’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1423:41: 1423 | *t1094 - t113*t114*t1098 | ^ Warning: ‘t392’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1423:41: Warning: ‘t389’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: 1438 | + t403*t1066 + t403*t1069) | ^ Warning: ‘t385’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: Warning: ‘t383’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: Warning: ‘t380’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) | ^ Warning: ‘t379’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: ‘t376’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: ‘t375’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: ‘t372’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: ‘t371’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: 1438 | + t403*t1066 + t403*t1069) | ^ Warning: ‘t366’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: Warning: ‘t364’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: Warning: ‘t361’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) | ^ Warning: ‘t360’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: ‘t357’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: 1429 | *t114*t820*t1076 - t113*t114*t321*t1101 | ^ Warning: ‘t352’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1423:41: 1423 | *t1094 - t113*t114*t1098 | ^ Warning: ‘t350’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: 1438 | + t403*t1066 + t403*t1069) | ^ Warning: ‘t349’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1423:41: 1423 | *t1094 - t113*t114*t1098 | ^ Warning: ‘t347’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1391:132: 1391 | *t389*t315) + t113*t15*t535*t115 - t113*t314*t395 | ^ Warning: ‘t346’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: 1385 | *t902 - t113*t114*t906 | ^ Warning: ‘t343’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1377:25: 1377 | t874 = t342*t190 | ^ Warning: ‘t342’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1375:54: 1375 | - t76*t865*Clda)*sx0 | ^ Warning: ‘t340’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: 1438 | + t403*t1066 + t403*t1069) | ^ Warning: ‘t335’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: 1373 | *t331*t333*t253) | ^ Warning: ‘t334’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: Warning: ‘t333’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: Warning: ‘t332’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1400:31: 1400 | t1069 = t331*t333*t352 | ^ Warning: ‘t331’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: 1373 | *t331*t333*t253) | ^ Warning: ‘t330’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) | ^ Warning: ‘t329’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: 1438 | + t403*t1066 + t403*t1069) | ^ Warning: ‘t328’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: 1373 | *t331*t333*t253) | ^ Warning: ‘t327’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: 1438 | + t403*t1066 + t403*t1069) | ^ Warning: ‘t326’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) | ^ Warning: ‘t325’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: 1396 | *t114*t321*t909 | ^ Warning: ‘t323’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: Warning: ‘t322’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1350:94: 1350 | *t114*t820*t640) - (t113*t114*t321*t681) | ^ Warning: ‘t321’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: 1396 | *t114*t321*t909 | ^ Warning: ‘t319’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: Warning: ‘t318’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1350:94: 1350 | *t114*t820*t640) - (t113*t114*t321*t681) | ^ Warning: ‘t317’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1391:132: 1391 | *t389*t315) + t113*t15*t535*t115 - t113*t314*t395 | ^ Warning: ‘t315’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1332:30: 1332 | t113*t114*t678 | ^ Warning: ‘t314’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: 1385 | *t902 - t113*t114*t906 | ^ Warning: ‘t311’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1391:132: 1391 | *t389*t315) + t113*t15*t535*t115 - t113*t314*t395 | ^ Warning: ‘t308’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1391:132: Warning: ‘t307’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: 1385 | *t902 - t113*t114*t906 | ^ Warning: ‘t305’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) | ^ Warning: ‘t301’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: 1373 | *t331*t333*t253) | ^ Warning: ‘t300’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1334:33: 1334 | t759 = 0.1e1_dp/t299/t83 | ^ Warning: ‘t299’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) | ^ Warning: ‘t297’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: ‘t294’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: 1373 | *t331*t333*t253) | ^ Warning: ‘t293’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: Warning: ‘t288’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: Warning: ‘t283’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) | ^ Warning: ‘t280’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: ‘t277’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: 1373 | *t331*t333*t253) | ^ Warning: ‘t276’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) | ^ Warning: ‘t273’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: 1373 | *t331*t333*t253) | ^ Warning: ‘t272’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) | ^ Warning: ‘t270’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: ‘t267’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: 1373 | *t331*t333*t253) | ^ Warning: ‘t266’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) | ^ Warning: ‘t263’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: ‘t260’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: ‘t257’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: 1373 | *t331*t333*t253) | ^ Warning: ‘t256’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: 1396 | *t114*t321*t909 | ^ Warning: ‘t254’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) | ^ Warning: ‘t253’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: 1385 | *t902 - t113*t114*t906 | ^ Warning: ‘t251’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) | ^ Warning: ‘t250’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: 1385 | *t902 - t113*t114*t906 | ^ Warning: ‘t248’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1350:94: 1350 | *t114*t820*t640) - (t113*t114*t321*t681) | ^ Warning: ‘t247’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: 1385 | *t902 - t113*t114*t906 | ^ Warning: ‘t244’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: Warning: ‘t241’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: Warning: ‘t240’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: Warning: ‘t238’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1416:88: 1416 | e_ndrho_rho = e_ndrho_rho + (-0.4e1_dp/0.3e1_dp*t235*t408 - t76*t1073*Clda)*sx0 | ^ Warning: ‘t235’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) | ^ Warning: ‘t232’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1319:63: 1319 | *t158*t624 + 2._dp*t32*t66*t4*t14*t158 | ^ Warning: ‘t231’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1319:63: Warning: ‘t229’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) | ^ Warning: ‘t228’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: 1429 | *t114*t820*t1076 - t113*t114*t321*t1101 | ^ Warning: ‘t227’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: 1305 | (48._dp*t224*t181) | ^ Warning: ‘t224’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: Warning: ‘t220’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: Warning: ‘t219’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: Warning: ‘t216’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: Warning: ‘t215’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) | ^ Warning: ‘t213’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1301:25: 1301 | t543 = t212*t156 | ^ Warning: ‘t212’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1398:31: 1398 | t1062 = t851*t852*t211 | ^ Warning: ‘t211’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1300:72: 1300 | - 0.16e2_dp/0.3e1_dp*t207*t139*t142 - (16._dp*t208*t146) | ^ Warning: ‘t208’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1300:72: Warning: ‘t207’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1397:30: 1397 | t1056 = 0.1e1_dp/t206 | ^ Warning: ‘t206’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1300:72: 1300 | - 0.16e2_dp/0.3e1_dp*t207*t139*t142 - (16._dp*t208*t146) | ^ Warning: ‘t203’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1300:72: Warning: ‘t202’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) | ^ Warning: ‘t199’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: 1385 | *t902 - t113*t114*t906 | ^ Warning: ‘t197’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) | ^ Warning: ‘t194’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1391:132: 1391 | *t389*t315) + t113*t15*t535*t115 - t113*t314*t395 | ^ Warning: ‘t191’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1377:25: 1377 | t874 = t342*t190 | ^ Warning: ‘t190’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1298:53: 1298 | t193 + 0.6e1_dp*t68*t69*t520*t71 | ^ Warning: ‘t189’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) | ^ Warning: ‘t188’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: Warning: ‘t186’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1298:53: 1298 | t193 + 0.6e1_dp*t68*t69*t520*t71 | ^ Warning: ‘t185’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: 1396 | *t114*t321*t909 | ^ Warning: ‘t184’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: 1305 | (48._dp*t224*t181) | ^ Warning: ‘t181’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: Warning: ‘t175’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: 1287 | t12*t61) | ^ Warning: ‘t173’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: 1305 | (48._dp*t224*t181) | ^ Warning: ‘t169’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: 1287 | t12*t61) | ^ Warning: ‘t168’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: Warning: ‘t167’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: 1305 | (48._dp*t224*t181) | ^ Warning: ‘t166’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1288:24: 1288 | t508 = t165*t13 | ^ Warning: ‘t165’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: 1287 | t12*t61) | ^ Warning: ‘t159’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1319:63: 1319 | *t158*t624 + 2._dp*t32*t66*t4*t14*t158 | ^ Warning: ‘t158’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1298:53: 1298 | t193 + 0.6e1_dp*t68*t69*t520*t71 | ^ Warning: ‘t157’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1301:25: 1301 | t543 = t212*t156 | ^ Warning: ‘t156’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1324:24: 1324 | t656 = t31*t154 | ^ Warning: ‘t154’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1278:33: 1278 | t454 = 0.1e1_dp/t153/t65 | ^ Warning: ‘t153’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1298:53: 1298 | t193 + 0.6e1_dp*t68*t69*t520*t71 | ^ Warning: ‘t151’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) | ^ Warning: ‘t150’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: 1373 | *t331*t333*t253) | ^ Warning: ‘t149’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) | ^ Warning: ‘t146’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: ‘t142’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1271:25: 1271 | t430 = t141*t135 | ^ Warning: ‘t141’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1276:55: 1276 | /0.3e1_dp*t140*t434 + (20._dp*t22*t438) | ^ Warning: ‘t140’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) | ^ Warning: ‘t139’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: ‘t132’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1391:132: 1391 | *t389*t315) + t113*t15*t535*t115 - t113*t314*t395 | ^ Warning: ‘t131’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1290:24: 1290 | t515 = t42*t130 | ^ Warning: ‘t130’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1269:34: 1269 | t425 = t54*r3*t56*t6*t129 | ^ Warning: ‘t129’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) | ^ Warning: ‘t126’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1276:55: 1276 | /0.3e1_dp*t140*t434 + (20._dp*t22*t438) | ^ Warning: ‘t125’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) | ^ Warning: ‘t124’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: 1373 | *t331*t333*t253) | ^ Warning: ‘t98’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: Warning: ‘t97’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: 1438 | + t403*t1066 + t403*t1069) | ^ Warning: ‘t95’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: 1429 | *t114*t820*t1076 - t113*t114*t321*t1101 | ^ Warning: ‘t94’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1197:22: 1197 | t299 = t93**2 | ^ Warning: ‘t93’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: 1373 | *t331*t333*t253) | ^ Warning: ‘t92’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1270:27: 1270 | t428 = t21/t9/t425 | ^ Warning: ‘t9’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1238:47: 1238 | t364 = f12*(2._dp*t343*t89 + t79*t361) | ^ Warning: ‘t89’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: 1373 | *t331*t333*t253) | ^ Warning: ‘t88’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: 1438 | + t403*t1066 + t403*t1069) | ^ Warning: ‘t86’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: 1396 | *t114*t321*t909 | ^ Warning: ‘t84’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1399:35: 1399 | t1066 = t331*t332*t227*t83 | ^ Warning: ‘t83’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1234:53: 1234 | t352 = 2._dp*t343*t81 + t79*t347 - t113*t350 | ^ Warning: ‘t81’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: 1396 | *t114*t321*t909 | ^ Warning: ‘t80’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: 1373 | *t331*t333*t253) | ^ Warning: ‘t79’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1339:23: 1339 | t811 = t78*t16 | ^ Warning: ‘t78’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1439:62: 1439 | e_ndrho_ndrho = e_ndrho_ndrho + (-t76*t1205*Clda)*sx0 | ^ Warning: ‘t76’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1320:22: 1320 | t633 = t74**2 | ^ Warning: ‘t74’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1319:63: 1319 | *t158*t624 + 2._dp*t32*t66*t4*t14*t158 | ^ Warning: ‘t73’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) | ^ Warning: ‘t72’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: 1373 | *t331*t333*t253) | ^ Warning: ‘t70’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1418:24: 1418 | t1080 = t69*t13 | ^ Warning: ‘t69’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1298:53: 1298 | t193 + 0.6e1_dp*t68*t69*t520*t71 | ^ Warning: ‘t68’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1319:63: 1319 | *t158*t624 + 2._dp*t32*t66*t4*t14*t158 | ^ Warning: ‘t67’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1162:25: 1162 | t231 = t66*ndrho | ^ Warning: ‘t66’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: 1373 | *t331*t333*t253) | ^ Warning: ‘t65’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1316:30: 1316 | a5*t18*t52*t63 | ^ Warning: ‘t63’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: 1287 | t12*t61) | ^ Warning: ‘t61’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1131:31: 1131 | t181 = t58/t59/rho*t61 | ^ Warning: ‘t59’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: 1287 | t12*t61) | ^ Warning: ‘t53’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1276:55: 1276 | /0.3e1_dp*t140*t434 + (20._dp*t22*t438) | ^ Warning: ‘t5’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1316:30: 1316 | a5*t18*t52*t63 | ^ Warning: ‘t47’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: 1287 | t12*t61) | ^ Warning: ‘t46’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1272:26: 1272 | t434 = t44*t28*t7 | ^ Warning: ‘t44’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1290:24: 1290 | t515 = t42*t130 | ^ Warning: ‘t42’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: 1287 | t12*t61) | ^ Warning: ‘t40’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: Warning: ‘t37’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1158:26: 1158 | t224 = a5*t36*t52 | ^ Warning: ‘t36’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: 1287 | t12*t61) | ^ Warning: ‘t34’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: Warning: ‘t33’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1281:32: 1281 | t465 = t32*t154*t78*t42 | ^ Warning: ‘t32’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: 1396 | *t114*t321*t909 | ^ Warning: ‘t31’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: 1438 | + t403*t1066 + t403*t1069) | ^ Warning: ‘t29’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1273:28: 1273 | t438 = t24*t173*t28 | ^ Warning: ‘t28’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1292:23: 1292 | t520 = t26*t15 | ^ Warning: ‘t26’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: 1287 | t12*t61) | ^ Warning: ‘t25’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1273:28: 1273 | t438 = t24*t173*t28 | ^ Warning: ‘t24’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1276:55: 1276 | /0.3e1_dp*t140*t434 + (20._dp*t22*t438) | ^ Warning: ‘t22’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1276:55: Warning: ‘t2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1276:55: Warning: ‘t19’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1316:30: 1316 | a5*t18*t52*t63 | ^ Warning: ‘t18’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) | ^ Warning: ‘t16’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) | ^ Warning: ‘t15’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1319:63: 1319 | *t158*t624 + 2._dp*t32*t66*t4*t14*t158 | ^ Warning: ‘t14’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1418:24: 1418 | t1080 = t69*t13 | ^ Warning: ‘t13’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1375:54: 1375 | - t76*t865*Clda)*sx0 | ^ Warning: ‘t122’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: 1373 | *t331*t333*t253) | ^ Warning: ‘t12’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: 1429 | *t114*t820*t1076 - t113*t114*t321*t1101 | ^ Warning: ‘t116’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: Warning: ‘t115’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1332:30: 1332 | t113*t114*t678 | ^ Warning: ‘t114’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: 1385 | *t902 - t113*t114*t906 | ^ Warning: ‘t113’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1229:24: 1229 | t343 = t342*t11 | ^ Warning: ‘t11’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: 1438 | + t403*t1066 + t403*t1069) | ^ Warning: ‘t109’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: 1373 | *t331*t333*t253) | ^ Warning: ‘t107’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: 1438 | + t403*t1066 + t403*t1069) | ^ Warning: ‘t104’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: 1373 | *t331*t333*t253) | ^ Warning: ‘t103’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: Warning: ‘t101’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: Warning: ‘t100’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1217:22: 1217 | t328 = t3*t10 | ^ Warning: ‘t10’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1148:24: 1148 | t206 = t1*ndrho | ^ Warning: ‘t1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5635:90: 5635 | 1.0_dp/Q*(dQrho*dQndrho + d2Qrhondrho) + 1.0_dp/(Q*Q)*dQrho*dQndrho | ^ Warning: ‘dqrho’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:362:76: 362 | REAL(KIND=dp) :: d2Qndrhondrho, d2Qrhondrho, d2Qrhorho, dQndrho, dQrho, Q, t1, t10, t100, & | ^ note: ‘dqrho’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: 885 | *t71*t678)/0.2e1_dp) | ^ Warning: ‘dqndrho’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:912:88: 912 | e_ndrho_rho = e_ndrho_rho + (-0.4e1_dp/0.3e1_dp*t269*t520 - t76*t1369*Clda)*sx0 | ^ Warning: ‘t520’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: 948 | *t1365)) | ^ Warning: ‘t515’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: ‘t514’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: ‘t513’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:929:56: 929 | *t148*t983*t1372 - t147*t148*t404*t1395 | ^ Warning: ‘t511’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:929:56: Warning: ‘t510’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:929:56: Warning: ‘t508’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:929:56: Warning: ‘t507’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:929:56: Warning: ‘t505’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:919:32: 919 | t147*t148*t1392 | ^ Warning: ‘t504’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:919:32: Warning: ‘t501’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: 948 | *t1365)) | ^ Warning: ‘t497’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: ‘t495’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: ‘t491’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:886:26: 886 | t1263 = t489*t136 | ^ Warning: ‘t489’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: 948 | *t1365)) | ^ Warning: ‘t485’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: ‘t484’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: ‘t480’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: 885 | *t71*t678)/0.2e1_dp) | ^ Warning: ‘t479’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: Warning: ‘t478’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: 948 | *t1365)) | ^ Warning: ‘t476’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:870:45: 870 | + t888*t148*t889*t261) | ^ Warning: ‘t475’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: 885 | *t71*t678)/0.2e1_dp) | ^ Warning: ‘t472’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: 948 | *t1365)) | ^ Warning: ‘t465’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: ‘t463’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: ‘t449’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: ‘t447’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: ‘t446’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:921:112: 921 | t66 - 2._dp*t440*t432 + 2._dp*t86*t1388 - t86*t1392) | ^ Warning: ‘t444’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:866:93: 866 | t432 - t440*t284 + 2._dp*t86*t1110 - t86*t1114) | ^ Warning: ‘t443’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:866:93: Warning: ‘t440’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: 948 | *t1365)) | ^ Warning: ‘t435’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:919:32: 919 | t147*t148*t1392 | ^ Warning: ‘t433’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:921:112: 921 | t66 - 2._dp*t440*t432 + 2._dp*t86*t1388 - t86*t1392) | ^ Warning: ‘t432’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:919:32: 919 | t147*t148*t1392 | ^ Warning: ‘t430’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:892:72: 892 | (2._dp*t501*t398) + t147*t15*t647*t149 - t147*t397*t507 | ^ Warning: ‘t429’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: 862 | - t147*t148*t1114 | ^ Warning: ‘t426’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:853:26: 853 | t1082 = t425*t224 | ^ Warning: ‘t425’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:851:55: 851 | - t76*t1073*Clda)*sx0 | ^ Warning: ‘t423’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: 948 | *t1365)) | ^ Warning: ‘t418’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: 849 | + (t412)*t414*t416*(t287)) | ^ Warning: ‘t417’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: ‘t416’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:900:35: 900 | t1362 = t414*t415*t261*t83 | ^ Warning: ‘t415’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: 849 | + (t412)*t414*t416*(t287)) | ^ Warning: ‘t414’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: ‘t413’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: 911 | + t412*t1362 + t412*t1365)) | ^ Warning: ‘t412’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: 948 | *t1365)) | ^ Warning: ‘t411’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: 849 | + (t412)*t414*t416*(t287)) | ^ Warning: ‘t410’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: 948 | *t1365)) | ^ Warning: ‘t409’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: 911 | + t412*t1362 + t412*t1365)) | ^ Warning: ‘t408’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: 897 | *t148*t404*t1117 | ^ Warning: ‘t406’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: Warning: ‘t405’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:818:51: 818 | *(t628)*(t391) + (4._dp*t394*t406) | ^ Warning: ‘t404’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: 897 | *t148*t404*t1117 | ^ Warning: ‘t402’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: Warning: ‘t401’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:818:51: 818 | *(t628)*(t391) + (4._dp*t394*t406) | ^ Warning: ‘t400’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:892:72: 892 | (2._dp*t501*t398) + t147*t15*t647*t149 - t147*t397*t507 | ^ Warning: ‘t398’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:776:26: 776 | *t148*t788 | ^ Warning: ‘t397’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: 862 | - t147*t148*t1114 | ^ Warning: ‘t394’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:892:72: 892 | (2._dp*t501*t398) + t147*t15*t647*t149 - t147*t397*t507 | ^ Warning: ‘t391’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:892:72: Warning: ‘t390’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: 862 | - t147*t148*t1114 | ^ Warning: ‘t388’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: 911 | + t412*t1362 + t412*t1365)) | ^ Warning: ‘t384’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: 849 | + (t412)*t414*t416*(t287)) | ^ Warning: ‘t383’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: 911 | + t412*t1362 + t412*t1365)) | ^ Warning: ‘t381’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: Warning: ‘t377’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: Warning: ‘t376’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: Warning: ‘t374’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:799:25: 799 | t952 = t372*t136 | ^ Warning: ‘t372’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: 885 | *t71*t678)/0.2e1_dp) | ^ Warning: ‘t368’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: Warning: ‘t367’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: Warning: ‘t363’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: 849 | + (t412)*t414*t416*(t287)) | ^ Warning: ‘t362’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: 885 | *t71*t678)/0.2e1_dp) | ^ Warning: ‘t361’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: Warning: ‘t359’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: 897 | *t148*t404*t1117 | ^ Warning: ‘t358’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: 849 | + (t412)*t414*t416*(t287)) | ^ Warning: ‘t357’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: ‘t356’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: ‘t355’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: ‘t347’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: ‘t345’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: ‘t344’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:793:30: 793 | t910 = t119*t343*t123 | ^ Warning: ‘t343’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: 849 | + (t412)*t414*t416*(t287)) | ^ Warning: ‘t342’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:870:45: 870 | + t888*t148*t889*t261) | ^ Warning: ‘t340’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: 849 | + (t412)*t414*t416*(t287)) | ^ Warning: ‘t339’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: ‘t338’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: ‘t336’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: 885 | *t71*t678)/0.2e1_dp) | ^ Warning: ‘t327’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: 849 | + (t412)*t414*t416*(t287)) | ^ Warning: ‘t326’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:782:24: 782 | t854 = t323*t83 | ^ Warning: ‘t323’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: 885 | *t71*t678)/0.2e1_dp) | ^ Warning: ‘t321’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: Warning: ‘t314’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: 911 | + t412*t1362 + t412*t1365)) | ^ Warning: ‘t307’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: 849 | + (t412)*t414*t416*(t287)) | ^ Warning: ‘t306’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: 911 | + t412*t1362 + t412*t1365)) | ^ Warning: ‘t304’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: 885 | *t71*t678)/0.2e1_dp) | ^ Warning: ‘t303’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:866:93: 866 | t432 - t440*t284 + 2._dp*t86*t1110 - t86*t1114) | ^ Warning: ‘t301’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:780:132: 780 | *t553*t66 - 2._dp*t297*t284 + 2._dp*t86*t784 - t86*t788)) | ^ Warning: ‘t300’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:866:93: 866 | t432 - t440*t284 + 2._dp*t86*t1110 - t86*t1114) | ^ Warning: ‘t297’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:866:93: Warning: ‘t294’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:866:93: Warning: ‘t291’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:780:132: 780 | *t553*t66 - 2._dp*t297*t284 + 2._dp*t86*t784 - t86*t788)) | ^ Warning: ‘t290’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: 897 | *t148*t404*t1117 | ^ Warning: ‘t288’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: 911 | + t412*t1362 + t412*t1365)) | ^ Warning: ‘t287’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: 862 | - t147*t148*t1114 | ^ Warning: ‘t285’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:866:93: 866 | t432 - t440*t284 + 2._dp*t86*t1110 - t86*t1114) | ^ Warning: ‘t284’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: 862 | - t147*t148*t1114 | ^ Warning: ‘t282’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:818:51: 818 | *(t628)*(t391) + (4._dp*t394*t406) | ^ Warning: ‘t281’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: 862 | - t147*t148*t1114 | ^ Warning: ‘t278’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: Warning: ‘t275’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: Warning: ‘t274’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: Warning: ‘t272’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:912:88: 912 | e_ndrho_rho = e_ndrho_rho + (-0.4e1_dp/0.3e1_dp*t269*t520 - t76*t1369*Clda)*sx0 | ^ Warning: ‘t269’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) | ^ Warning: ‘t266’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:763:63: 763 | *t192*t735 + 2._dp*t32*t66*t4*t14*t192 | ^ Warning: ‘t265’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:763:63: Warning: ‘t263’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) | ^ Warning: ‘t262’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:870:45: 870 | + t888*t148*t889*t261) | ^ Warning: ‘t261’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: 749 | (48._dp*t258*t215) | ^ Warning: ‘t258’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: Warning: ‘t254’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: Warning: ‘t253’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: Warning: ‘t250’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: Warning: ‘t249’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) | ^ Warning: ‘t247’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:744:25: 744 | t655 = t246*t190 | ^ Warning: ‘t246’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:899:33: 899 | t1358 = t1059*t1060*t245 | ^ Warning: ‘t245’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:743:72: 743 | - 0.16e2_dp/0.3e1_dp*t241*t173*t176 - (16._dp*t242*t180) | ^ Warning: ‘t242’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:743:72: Warning: ‘t241’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:898:30: 898 | t1352 = 0.1e1_dp/t240 | ^ Warning: ‘t240’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:743:72: 743 | - 0.16e2_dp/0.3e1_dp*t241*t173*t176 - (16._dp*t242*t180) | ^ Warning: ‘t237’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:743:72: Warning: ‘t236’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) | ^ Warning: ‘t233’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: 862 | - t147*t148*t1114 | ^ Warning: ‘t231’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) | ^ Warning: ‘t228’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:892:72: 892 | (2._dp*t501*t398) + t147*t15*t647*t149 - t147*t397*t507 | ^ Warning: ‘t225’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:853:26: 853 | t1082 = t425*t224 | ^ Warning: ‘t224’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:741:53: 741 | t227 + 0.6e1_dp*t68*t69*t632*t71 | ^ Warning: ‘t223’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) | ^ Warning: ‘t222’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: Warning: ‘t220’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:741:53: 741 | t227 + 0.6e1_dp*t68*t69*t632*t71 | ^ Warning: ‘t219’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: 897 | *t148*t404*t1117 | ^ Warning: ‘t218’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: 749 | (48._dp*t258*t215) | ^ Warning: ‘t215’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: Warning: ‘t209’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: 730 | t12*t61) | ^ Warning: ‘t207’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: 749 | (48._dp*t258*t215) | ^ Warning: ‘t203’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: 730 | t12*t61) | ^ Warning: ‘t202’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: Warning: ‘t201’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: 749 | (48._dp*t258*t215) | ^ Warning: ‘t200’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:731:24: 731 | t620 = t199*t13 | ^ Warning: ‘t199’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: 730 | t12*t61) | ^ Warning: ‘t193’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:763:63: 763 | *t192*t735 + 2._dp*t32*t66*t4*t14*t192 | ^ Warning: ‘t192’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:741:53: 741 | t227 + 0.6e1_dp*t68*t69*t632*t71 | ^ Warning: ‘t191’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:744:25: 744 | t655 = t246*t190 | ^ Warning: ‘t190’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:871:26: 871 | t1242 = t245*t188 | ^ Warning: ‘t188’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:721:33: 721 | t566 = 0.1e1_dp/t187/t65 | ^ Warning: ‘t187’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:741:53: 741 | t227 + 0.6e1_dp*t68*t69*t632*t71 | ^ Warning: ‘t185’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) | ^ Warning: ‘t184’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: 849 | + (t412)*t414*t416*(t287)) | ^ Warning: ‘t183’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: 749 | (48._dp*t258*t215) | ^ Warning: ‘t180’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: Warning: ‘t176’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:713:25: 713 | t542 = t175*t169 | ^ Warning: ‘t175’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:719:70: 719 | *t550) | ^ Warning: ‘t174’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: 749 | (48._dp*t258*t215) | ^ Warning: ‘t173’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: 849 | + (t412)*t414*t416*(t287)) | ^ Warning: ‘t172’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:743:72: 743 | - 0.16e2_dp/0.3e1_dp*t241*t173*t176 - (16._dp*t242*t180) | ^ Warning: ‘t166’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:892:72: 892 | (2._dp*t501*t398) + t147*t15*t647*t149 - t147*t397*t507 | ^ Warning: ‘t165’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: 849 | + (t412)*t414*t416*(t287)) | ^ Warning: ‘t164’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:711:34: 711 | t537 = t54*r3*t56*t6*t163 | ^ Warning: ‘t163’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:743:72: 743 | - 0.16e2_dp/0.3e1_dp*t241*t173*t176 - (16._dp*t242*t180) | ^ Warning: ‘t160’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:719:70: 719 | *t550) | ^ Warning: ‘t159’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: 849 | + (t412)*t414*t416*(t287)) | ^ Warning: ‘t158’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: 948 | *t1365)) | ^ Warning: ‘t95’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:929:56: 929 | *t148*t983*t1372 - t147*t148*t404*t1395 | ^ Warning: ‘t94’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: 849 | + (t412)*t414*t416*(t287)) | ^ Warning: ‘t93’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: ‘t92’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: ‘t91’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:712:27: 712 | t540 = t21/t9/t537 | ^ Warning: ‘t9’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:674:41: 674 | t446 = 2._dp*t426*t89 + t79*t444 | ^ Warning: ‘t89’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:780:132: 780 | *t553*t66 - 2._dp*t297*t284 + 2._dp*t86*t784 - t86*t788)) | ^ Warning: ‘t88’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:921:112: 921 | t66 - 2._dp*t440*t432 + 2._dp*t86*t1388 - t86*t1392) | ^ Warning: ‘t86’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: 897 | *t148*t404*t1117 | ^ Warning: ‘t84’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: 948 | *t1365)) | ^ Warning: ‘t83’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:670:53: 670 | t435 = 2._dp*t426*t81 + t79*t430 - t147*t433 | ^ Warning: ‘t81’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: 897 | *t148*t404*t1117 | ^ Warning: ‘t80’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:776:26: 776 | *t148*t788 | ^ Warning: ‘t79’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:807:24: 807 | t1023 = t78*t16 | ^ Warning: ‘t78’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:949:62: 949 | e_ndrho_ndrho = e_ndrho_ndrho + (-t76*t1561*Clda)*sx0 | ^ Warning: ‘t76’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:764:22: 764 | t744 = t74**2 | ^ Warning: ‘t74’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:763:63: 763 | *t192*t735 + 2._dp*t32*t66*t4*t14*t192 | ^ Warning: ‘t73’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) | ^ Warning: ‘t72’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:776:26: 776 | *t148*t788 | ^ Warning: ‘t70’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:870:45: 870 | + t888*t148*t889*t261) | ^ Warning: ‘t69’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:741:53: 741 | t227 + 0.6e1_dp*t68*t69*t632*t71 | ^ Warning: ‘t68’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:763:63: 763 | *t192*t735 + 2._dp*t32*t66*t4*t14*t192 | ^ Warning: ‘t67’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:572:25: 572 | t265 = t66*ndrho | ^ Warning: ‘t66’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:658:24: 658 | t416 = t415*t65 | ^ Warning: ‘t65’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:760:30: 760 | a5*t18*t52*t63 | ^ Warning: ‘t63’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: 730 | t12*t61) | ^ Warning: ‘t61’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:541:31: 541 | t215 = t58/t59/rho*t61 | ^ Warning: ‘t59’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: 730 | t12*t61) | ^ Warning: ‘t53’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:719:70: 719 | *t550) | ^ Warning: ‘t5’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:760:30: 760 | a5*t18*t52*t63 | ^ Warning: ‘t47’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: 730 | t12*t61) | ^ Warning: ‘t46’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:714:26: 714 | t546 = t44*t28*t7 | ^ Warning: ‘t44’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:733:24: 733 | t627 = t42*t164 | ^ Warning: ‘t42’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: 730 | t12*t61) | ^ Warning: ‘t40’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: Warning: ‘t37’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:568:26: 568 | t258 = a5*t36*t52 | ^ Warning: ‘t36’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: 730 | t12*t61) | ^ Warning: ‘t34’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: Warning: ‘t33’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:724:32: 724 | t577 = t32*t188*t78*t42 | ^ Warning: ‘t32’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:821:23: 821 | t1057 = t31**2 | ^ Warning: ‘t31’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:760:30: 760 | a5*t18*t52*t63 | ^ Warning: ‘t29’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:715:28: 715 | t550 = t24*t207*t28 | ^ Warning: ‘t28’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:735:23: 735 | t632 = t26*t15 | ^ Warning: ‘t26’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: 730 | t12*t61) | ^ Warning: ‘t25’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:715:28: 715 | t550 = t24*t207*t28 | ^ Warning: ‘t24’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:719:70: 719 | *t550) | ^ Warning: ‘t22’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:719:70: Warning: ‘t2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:719:70: Warning: ‘t19’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:760:30: 760 | a5*t18*t52*t63 | ^ Warning: ‘t18’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) | ^ Warning: ‘t16’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:851:55: 851 | - t76*t1073*Clda)*sx0 | ^ Warning: ‘t156’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:929:56: 929 | *t148*t983*t1372 - t147*t148*t404*t1395 | ^ Warning: ‘t150’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:866:93: 866 | t432 - t440*t284 + 2._dp*t86*t1110 - t86*t1114) | ^ Warning: ‘t15’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:929:56: 929 | *t148*t983*t1372 - t147*t148*t404*t1395 | ^ Warning: ‘t149’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:776:26: 776 | *t148*t788 | ^ Warning: ‘t148’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: 862 | - t147*t148*t1114 | ^ Warning: ‘t147’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: 911 | + t412*t1362 + t412*t1365)) | ^ Warning: ‘t143’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: 849 | + (t412)*t414*t416*(t287)) | ^ Warning: ‘t142’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:763:63: 763 | *t192*t735 + 2._dp*t32*t66*t4*t14*t192 | ^ Warning: ‘t14’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: 948 | *t1365)) | ^ Warning: ‘t139’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:630:25: 630 | t374 = t135*t136 | ^ Warning: ‘t135’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: 948 | *t1365)) | ^ Warning: ‘t130’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: 849 | + (t412)*t414*t416*(t287)) | ^ Warning: ‘t13’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: 885 | *t71*t678)/0.2e1_dp) | ^ Warning: ‘t127’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: Warning: ‘t126’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: 849 | + (t412)*t414*t416*(t287)) | ^ Warning: ‘t125’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: 885 | *t71*t678)/0.2e1_dp) | ^ Warning: ‘t123’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: 849 | + (t412)*t414*t416*(t287)) | ^ Warning: ‘t122’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: ‘t121’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:819:25: 819 | t1055 = t411*t12 | ^ Warning: ‘t12’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:617:30: 617 | t355 = t119*t120*t122 | ^ Warning: ‘t119’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:787:24: 787 | t875 = t97*t118 | ^ Warning: ‘t118’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: 948 | *t1365)) | ^ Warning: ‘t117’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: ‘t114’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:602:30: 602 | t326 = t110/t111/t323 | ^ Warning: ‘t111’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:665:24: 665 | t426 = t425*t11 | ^ Warning: ‘t11’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: 849 | + (t412)*t414*t416*(t287)) | ^ Warning: ‘t109’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:653:22: 653 | t411 = t3*t10 | ^ Warning: ‘t10’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:558:24: 558 | t240 = t1*ndrho | ^ Warning: ‘t1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5635:90: 5635 | 1.0_dp/Q*(dQrho*dQndrho + d2Qrhondrho) + 1.0_dp/(Q*Q)*dQrho*dQndrho | ^ Warning: ‘dqrho’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4531:76: 4531 | REAL(KIND=dp) :: d2Qndrhondrho, d2Qrhondrho, d2Qrhorho, dQndrho, dQrho, Q, t1, t10, t100, & | ^ note: ‘dqrho’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5671:94: 5671 | 1.0_dp/(Q*Q)*(-Q*dQndrho*dQndrho - Q*d2Qndrhondrho + dQndrho*dQndrho) | ^ Warning: ‘dqndrho’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4531:69: 4531 | REAL(KIND=dp) :: d2Qndrhondrho, d2Qrhondrho, d2Qrhorho, dQndrho, dQrho, Q, t1, t10, t100, & | ^ note: ‘dqndrho’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5146:97: 5146 | e_ndrho_rho = e_ndrho_rho + (-0.4e1_dp/0.3e1_dp*t283*t545 - t80*(t1319 + t1443)*Clda)*sx | ^ Warning: ‘t545’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: 5176 | *t421*t422*t1533 | ^ Warning: ‘t540’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: Warning: ‘t539’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5195:132: 5195 | *t155*t44*t772) | ^ Warning: ‘t533’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5195:132: Warning: ‘t530’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 | ^ Warning: ‘t526’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5170:58: 5170 | + 0.3e1_dp/0.2e1_dp*(t400)*(t405)*(t1566) | ^ Warning: ‘t522’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5170:58: Warning: ‘t519’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5170:58: Warning: ‘t513’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5170:58: Warning: ‘t510’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: 5145 | *t155*t44*t726 | ^ Warning: ‘t505’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5182:80: 5182 | *t367*t405*t1552) | ^ Warning: ‘t501’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5102:26: 5102 | t1288 = t864*t500 | ^ Warning: ‘t500’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5182:80: 5182 | *t367*t405*t1552) | ^ Warning: ‘t498’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5189:67: 5189 | (t1537) - 0.75e2_dp/0.4e1_dp*(t340)*(t793)*(t1529) | ^ Warning: ‘t487’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5076:26: 5076 | t1181 = t931*t486 | ^ Warning: ‘t486’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5189:67: 5189 | (t1537) - 0.75e2_dp/0.4e1_dp*(t340)*(t793)*(t1529) | ^ Warning: ‘t484’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: 5176 | *t421*t422*t1533 | ^ Warning: ‘t478’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5120:26: 5120 | t1351 = t476*t420 | ^ Warning: ‘t476’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5121:26: 5121 | t1382 = t136*t475 | ^ Warning: ‘t475’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5151:90: 5151 | *t19 + 12._dp*g3*t1*t24*t32) | ^ Warning: ‘t473’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: 5073 | - (16._dp*t469*t203)) | ^ Warning: ‘t472’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: Warning: ‘t469’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: Warning: ‘t468’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: Warning: ‘t465’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: Warning: ‘t464’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: 5176 | *t421*t422*t1533 | ^ Warning: ‘t459’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: Warning: ‘t457’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5129:26: 5129 | t1413 = t140*t456 | ^ Warning: ‘t456’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5154:111: 5154 | t68 - 2._dp*t450*t278 + 2._dp*t85*t752 - t85*t769) | ^ Warning: ‘t454’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5096:132: 5096 | - t450*t239 + 2._dp*t85*t706 - t85*t723) | ^ Warning: ‘t453’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5096:132: Warning: ‘t450’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5068:64: 5068 | - t80*(t1074 + t1118)*Clda)*sx | ^ Warning: ‘t444’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: 5145 | *t155*t44*t726 | ^ Warning: ‘t439’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: 5176 | *t421*t422*t1533 | ^ Warning: ‘t438’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5042:27: 5042 | t1049 = t437*t1048 | ^ Warning: ‘t437’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: 5176 | *t421*t422*t1533 | ^ Warning: ‘t435’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: Warning: ‘t434’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5039:30: 5039 | t1040 = t75/t433/t160 | ^ Warning: ‘t433’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 | ^ Warning: ‘t428’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: Warning: ‘t427’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) | ^ Warning: ‘t426’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: 5145 | *t155*t44*t726 | ^ Warning: ‘t423’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: Warning: ‘t422’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) | ^ Warning: ‘t421’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5170:58: 5170 | + 0.3e1_dp/0.2e1_dp*(t400)*(t405)*(t1566) | ^ Warning: ‘t420’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 | ^ Warning: ‘t417’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5055:107: 5055 | t1065*t422*t1066*t350) + (5._dp*t1071*t423) | ^ Warning: ‘t415’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 | ^ Warning: ‘t412’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) | ^ Warning: ‘t410’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5034:24: 5034 | *(t872) | ^ Warning: ‘t406’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5182:80: 5182 | *t367*t405*t1552) | ^ Warning: ‘t405’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5135:58: 5135 | + 0.3e1_dp/0.2e1_dp*(t400)*(t405)*(t1184) | ^ Warning: ‘t402’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5034:24: 5034 | *(t872) | ^ Warning: ‘t401’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5034:24: Warning: ‘t400’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5034:24: Warning: ‘t394’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5189:67: 5189 | (t1537) - 0.75e2_dp/0.4e1_dp*(t340)*(t793)*(t1529) | ^ Warning: ‘t393’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5128:65: 5128 | *t1270 + 0.5e1_dp/0.2e1_dp*(t388)*(t393)*(t1198) | ^ Warning: ‘t390’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 | ^ Warning: ‘t389’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5034:24: 5034 | *(t872) | ^ Warning: ‘t388’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: 5145 | *t155*t44*t726 | ^ Warning: ‘t382’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) | ^ Warning: ‘t379’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5092:61: 5092 | t1224*t375 - t110*t1155*t83*t118 + t920*t484 | ^ Warning: ‘t375’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4992:25: 4992 | t865 = t864*t374 | ^ Warning: ‘t374’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5092:61: 5092 | t1224*t375 - t110*t1155*t83*t118 + t920*t484 | ^ Warning: ‘t373’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5170:58: 5170 | + 0.3e1_dp/0.2e1_dp*(t400)*(t405)*(t1566) | ^ Warning: ‘t372’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5109:35: 5109 | *t487 + t1205*t342 | ^ Warning: ‘t369’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4989:116: 4989 | *t807) | ^ Warning: ‘t368’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5092:61: 5092 | t1224*t375 - t110*t1155*t83*t118 + t920*t484 | ^ Warning: ‘t367’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4989:116: 4989 | *t807) | ^ Warning: ‘t360’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5109:35: 5109 | *t487 + t1205*t342 | ^ Warning: ‘t359’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4989:116: 4989 | *t807) | ^ Warning: ‘t355’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5092:61: 5092 | t1224*t375 - t110*t1155*t83*t118 + t920*t484 | ^ Warning: ‘t352’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: 5145 | *t155*t44*t726 | ^ Warning: ‘t351’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 | ^ Warning: ‘t350’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5092:61: 5092 | t1224*t375 - t110*t1155*t83*t118 + t920*t484 | ^ Warning: ‘t346’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5100:32: 5100 | t1270 = t345*t127*t1189 | ^ Warning: ‘t345’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5109:35: 5109 | *t487 + t1205*t342 | ^ Warning: ‘t342’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5016:23: 5016 | *(t939) | ^ Warning: ‘t341’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5189:67: 5189 | (t1537) - 0.75e2_dp/0.4e1_dp*(t340)*(t793)*(t1529) | ^ Warning: ‘t340’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 | ^ Warning: ‘t334’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5075:26: 5075 | t1174 = t476*t333 | ^ Warning: ‘t333’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4962:33: 4962 | t782 = 0.1e1_dp/t332/t82 | ^ Warning: ‘t332’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: 5145 | *t155*t44*t726 | ^ Warning: ‘t330’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5017:25: 5017 | t956 = t136*t329 | ^ Warning: ‘t329’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: 5073 | - (16._dp*t469*t203)) | ^ Warning: ‘t327’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: 5003 | /0.3e1_dp*t321*t603 + (20._dp*t100*t607)) | ^ Warning: ‘t326’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: Warning: ‘t321’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: Warning: ‘t316’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: 5073 | - (16._dp*t469*t203)) | ^ Warning: ‘t313’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: Warning: ‘t310’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: 5003 | /0.3e1_dp*t321*t603 + (20._dp*t100*t607)) | ^ Warning: ‘t309’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 | ^ Warning: ‘t306’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) | ^ Warning: ‘t305’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 | ^ Warning: ‘t303’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5021:25: 5021 | t985 = t140*t302 | ^ Warning: ‘t302’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5096:132: 5096 | - t450*t239 + 2._dp*t85*t706 - t85*t723) | ^ Warning: ‘t300’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4982:132: 4982 | *t610*t68 - 2._dp*t296*t239 + 2._dp*t85*t620 - t85*t655)) | ^ Warning: ‘t299’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5096:132: 5096 | - t450*t239 + 2._dp*t85*t706 - t85*t723) | ^ Warning: ‘t296’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5096:132: Warning: ‘t293’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5096:132: Warning: ‘t290’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4982:132: 4982 | *t610*t68 - 2._dp*t296*t239 + 2._dp*t85*t620 - t85*t655)) | ^ Warning: ‘t289’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: 5145 | *t155*t44*t726 | ^ Warning: ‘t286’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5146:97: 5146 | e_ndrho_rho = e_ndrho_rho + (-0.4e1_dp/0.3e1_dp*t283*t545 - t80*(t1319 + t1443)*Clda)*sx | ^ Warning: ‘t283’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5092:61: 5092 | t1224*t375 - t110*t1155*t83*t118 + t920*t484 | ^ Warning: ‘t281’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4959:42: 4959 | t171*t752 - t210*t171*t769 | ^ Warning: ‘t279’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5154:111: 5154 | t68 - 2._dp*t450*t278 + 2._dp*t85*t752 - t85*t769) | ^ Warning: ‘t278’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: 4949 | t171*t706 - t210*t171*t723 | ^ Warning: ‘t277’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: 4943 | t229) - (48._dp*t274*t235)) | ^ Warning: ‘t274’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: Warning: ‘t270’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: Warning: ‘t269’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: Warning: ‘t266’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: Warning: ‘t265’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4959:42: 4959 | t171*t752 - t210*t171*t769 | ^ Warning: ‘t263’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: 4949 | t171*t706 - t210*t171*t723 | ^ Warning: ‘t262’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4936:24: 4936 | t667 = t14*t261 | ^ Warning: ‘t261’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4938:72: 4938 | - 0.16e2_dp/0.3e1_dp*t257*t196*t199 - (16._dp*t258*t203) | ^ Warning: ‘t258’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4938:72: Warning: ‘t257’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4956:46: 4956 | + 30._dp*a5*t21*t54*t65) | ^ Warning: ‘t256’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4938:72: 4938 | - 0.16e2_dp/0.3e1_dp*t257*t196*t199 - (16._dp*t258*t203) | ^ Warning: ‘t253’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4938:72: Warning: ‘t252’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: 4949 | t171*t706 - t210*t171*t723 | ^ Warning: ‘t249’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4939:24: 4939 | t700 = t248*t18 | ^ Warning: ‘t248’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: 5145 | *t155*t44*t726 | ^ Warning: ‘t246’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: 4949 | t171*t706 - t210*t171*t723 | ^ Warning: ‘t240’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5096:132: 5096 | - t450*t239 + 2._dp*t85*t706 - t85*t723) | ^ Warning: ‘t239’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4940:30: 4940 | t706 = t618*t238*t277 | ^ Warning: ‘t238’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: 4943 | t229) - (48._dp*t274*t235)) | ^ Warning: ‘t235’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: Warning: ‘t229’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: 4930 | /t12*t63)) | ^ Warning: ‘t227’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: 4943 | t229) - (48._dp*t274*t235)) | ^ Warning: ‘t223’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: 4930 | /t12*t63)) | ^ Warning: ‘t222’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: Warning: ‘t221’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: 4943 | t229) - (48._dp*t274*t235)) | ^ Warning: ‘t220’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 | ^ Warning: ‘t219’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: 4930 | /t12*t63)) | ^ Warning: ‘t213’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4956:46: 4956 | + 30._dp*a5*t21*t54*t65) | ^ Warning: ‘t212’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4921:33: 4921 | t618 = 0.1e1_dp/t211/t67 | ^ Warning: ‘t211’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4931:30: 4931 | t657 = t210*t171*t655 | ^ Warning: ‘t210’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: 4949 | t171*t706 - t210*t171*t723 | ^ Warning: ‘t208’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4904:35: 4904 | t575 = 4._dp*t11*t179*t207 | ^ Warning: ‘t207’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4897:24: 4897 | t558 = t14*t206 | ^ Warning: ‘t206’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: 5073 | - (16._dp*t469*t203)) | ^ Warning: ‘t203’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: Warning: ‘t199’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4913:25: 4913 | t599 = t198*t192 | ^ Warning: ‘t198’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4918:64: 4918 | 0.32e2_dp/0.3e1_dp*t197*t603 + (20._dp*t25*t607) | ^ Warning: ‘t197’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: 5073 | - (16._dp*t469*t203)) | ^ Warning: ‘t196’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5055:107: 5055 | t1065*t422*t1066*t350) + (5._dp*t1071*t423) | ^ Warning: ‘t195’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: 5073 | - (16._dp*t469*t203)) | ^ Warning: ‘t189’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4905:23: 4905 | t576 = t4*t188 | ^ Warning: ‘t188’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: 5073 | - (16._dp*t469*t203)) | ^ Warning: ‘t185’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4918:64: 4918 | 0.32e2_dp/0.3e1_dp*t197*t603 + (20._dp*t25*t607) | ^ Warning: ‘t184’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: 5073 | - (16._dp*t469*t203)) | ^ Warning: ‘t183’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: 4949 | t171*t706 - t210*t171*t723 | ^ Warning: ‘t180’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4982:132: 4982 | *t610*t68 - 2._dp*t296*t239 + 2._dp*t85*t620 - t85*t655)) | ^ Warning: ‘t179’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) | ^ Warning: ‘t178’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4911:34: 4911 | t594 = t56*r3*t58*t5*t177 | ^ Warning: ‘t177’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: 4949 | t171*t706 - t210*t171*t723 | ^ Warning: ‘t174’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: Warning: ‘t173’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4924:36: 4924 | t623 = 2._dp*t210*t171*t620 | ^ Warning: ‘t171’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: 4949 | t171*t706 - t210*t171*t723 | ^ Warning: ‘t170’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4935:25: 4935 | t664 = t248*t169 | ^ Warning: ‘t169’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: 5003 | /0.3e1_dp*t321*t603 + (20._dp*t100*t607)) | ^ Warning: ‘t99’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: Warning: ‘t97’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: Warning: ‘t96’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5135:58: 5135 | + 0.3e1_dp/0.2e1_dp*(t400)*(t405)*(t1184) | ^ Warning: ‘t95’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: 5176 | *t421*t422*t1533 | ^ Warning: ‘t94’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5170:58: 5170 | + 0.3e1_dp/0.2e1_dp*(t400)*(t405)*(t1566) | ^ Warning: ‘t93’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4784:22: 4784 | t332 = t92**2 | ^ Warning: ‘t92’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) | ^ Warning: ‘t91’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5023:29: 5023 | t995 = t140*t90*t108 | ^ Warning: ‘t90’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4925:32: 4925 | t632 = 0.1e1_dp/t9/t594 | ^ Warning: ‘t9’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5154:111: 5154 | t68 - 2._dp*t450*t278 + 2._dp*t85*t752 - t85*t769) | ^ Warning: ‘t88’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4982:132: 4982 | *t610*t68 - 2._dp*t296*t239 + 2._dp*t85*t620 - t85*t655)) | ^ Warning: ‘t87’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5154:111: 5154 | t68 - 2._dp*t450*t278 + 2._dp*t85*t752 - t85*t769) | ^ Warning: ‘t85’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5109:35: 5109 | *t487 + t1205*t342 | ^ Warning: ‘t84’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5189:67: 5189 | (t1537) - 0.75e2_dp/0.4e1_dp*(t340)*(t793)*(t1529) | ^ Warning: ‘t83’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4962:33: 4962 | t782 = 0.1e1_dp/t332/t82 | ^ Warning: ‘t82’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5196:71: 5196 | e_ndrho_ndrho = e_ndrho_ndrho + (-t80*(t1576 + t1672)*Clda)*sx | ^ Warning: ‘t80’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4912:27: 4912 | t597 = t24/t8/t594 | ^ Warning: ‘t8’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4961:22: 4961 | t774 = t78**2 | ^ Warning: ‘t78’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5040:23: 5040 | t1047 = t75**2 | ^ Warning: ‘t75’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4933:67: 4933 | + t623 - t657 + 0.10e2_dp/0.9e1_dp*t73*t219*t56*t58 | ^ Warning: ‘t73’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4978:64: 4978 | + t623 - t657 + 0.10e2_dp/0.9e1_dp*t72*t219*t192 | ^ Warning: ‘t72’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4757:53: 4757 | t281 = 2._dp*t249*t70 + t11*t263 - t210*t279 | ^ Warning: ‘t70’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4903:34: 4903 | t572 = 6._dp*t11*t569*t69 | ^ Warning: ‘t69’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5154:111: 5154 | t68 - 2._dp*t450*t278 + 2._dp*t85*t752 - t85*t769) | ^ Warning: ‘t68’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4720:22: 4720 | t211 = t67**2 | ^ Warning: ‘t67’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4956:46: 4956 | + 30._dp*a5*t21*t54*t65) | ^ Warning: ‘t65’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: 4930 | /t12*t63)) | ^ Warning: ‘t63’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4730:31: 4730 | t235 = t60/t61/rho*t63 | ^ Warning: ‘t61’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: 4930 | /t12*t63)) | ^ Warning: ‘t55’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4956:46: 4956 | + 30._dp*a5*t21*t54*t65) | ^ Warning: ‘t49’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: 4930 | /t12*t63)) | ^ Warning: ‘t48’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4914:26: 4914 | t603 = t46*t31*t6 | ^ Warning: ‘t46’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5055:107: 5055 | t1065*t422*t1066*t350) + (5._dp*t1071*t423) | ^ Warning: ‘t44’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: 4930 | /t12*t63)) | ^ Warning: ‘t42’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4905:23: 4905 | t576 = t4*t188 | ^ Warning: ‘t4’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: 4930 | /t12*t63)) | ^ Warning: ‘t39’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4753:26: 4753 | t274 = a5*t38*t54 | ^ Warning: ‘t38’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: 4930 | /t12*t63)) | ^ Warning: ‘t36’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: Warning: ‘t35’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4900:24: 4900 | t564 = t34*t212 | ^ Warning: ‘t34’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5151:90: 5151 | *t19 + 12._dp*g3*t1*t24*t32) | ^ Warning: ‘t32’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4915:28: 4915 | t607 = t27*t227*t31 | ^ Warning: ‘t31’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4902:23: 4902 | t569 = t29*t14 | ^ Warning: ‘t29’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: 4930 | /t12*t63)) | ^ Warning: ‘t28’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4915:28: 4915 | t607 = t27*t227*t31 | ^ Warning: ‘t27’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4918:64: 4918 | 0.32e2_dp/0.3e1_dp*t197*t603 + (20._dp*t25*t607) | ^ Warning: ‘t25’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4918:64: Warning: ‘t22’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4956:46: 4956 | + 30._dp*a5*t21*t54*t65) | ^ Warning: ‘t21’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4857:47: 4857 | t472 = 2._dp*t465*t19 + 4._dp*t469*t32 | ^ Warning: ‘t19’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4939:24: 4939 | t700 = t248*t18 | ^ Warning: ‘t18’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4918:64: 4918 | 0.32e2_dp/0.3e1_dp*t197*t603 + (20._dp*t25*t607) | ^ Warning: ‘t17’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5068:64: 5068 | - t80*(t1074 + t1118)*Clda)*sx | ^ Warning: ‘t167’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: 5176 | *t421*t422*t1533 | ^ Warning: ‘t161’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: Warning: ‘t160’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4918:64: 4918 | 0.32e2_dp/0.3e1_dp*t197*t603 + (20._dp*t25*t607) | ^ Warning: ‘t16’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5195:132: 5195 | *t155*t44*t772) | ^ Warning: ‘t156’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5055:107: 5055 | t1065*t422*t1066*t350) + (5._dp*t1071*t423) | ^ Warning: ‘t155’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) | ^ Warning: ‘t154’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: 5176 | *t421*t422*t1533 | ^ Warning: ‘t151’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: 5003 | /0.3e1_dp*t321*t603 + (20._dp*t100*t607)) | ^ Warning: ‘t15’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) | ^ Warning: ‘t146’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: 5176 | *t421*t422*t1533 | ^ Warning: ‘t145’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4990:25: 4990 | t863 = t125*t141 | ^ Warning: ‘t141’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: 5073 | - (16._dp*t469*t203)) | ^ Warning: ‘t14’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5122:26: 5122 | t1397 = t136*t137 | ^ Warning: ‘t137’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5195:132: 5195 | *t155*t44*t772) | ^ Warning: ‘t134’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5055:107: 5055 | t1065*t422*t1066*t350) + (5._dp*t1071*t423) | ^ Warning: ‘t133’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4959:42: 4959 | t171*t752 - t210*t171*t769 | ^ Warning: ‘t13’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5182:80: 5182 | *t367*t405*t1552) | ^ Warning: ‘t129’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4995:39: 4995 | t878 = 0.1e1_dp/t128/t115/t114 | ^ Warning: ‘t128’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 | ^ Warning: ‘t127’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5098:26: 5098 | t1264 = t125*t126 | ^ Warning: ‘t126’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5092:61: 5092 | t1224*t375 - t110*t1155*t83*t118 + t920*t484 | ^ Warning: ‘t122’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4975:34: 4975 | t811 = 0.1e1_dp/t121/t114 | ^ Warning: ‘t121’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4696:23: 4696 | t177 = t12*rho | ^ Warning: ‘t12’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: 5145 | *t155*t44*t726 | ^ Warning: ‘t118’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4966:39: 4966 | t792 = 0.1e1_dp/t117/t789/t114 | ^ Warning: ‘t117’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4790:34: 4790 | t345 = 0.1e1_dp/t117/t116 | ^ Warning: ‘t116’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 | ^ Warning: ‘t115’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5079:32: 5079 | t1190 = t372*t114*t1189 | ^ Warning: ‘t114’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5101:32: 5101 | t1277 = t372*t113*t1189 | ^ Warning: ‘t113’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5082:26: 5082 | t1208 = t110*t111 | ^ Warning: ‘t111’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4982:132: 4982 | *t610*t68 - 2._dp*t296*t239 + 2._dp*t85*t620 - t85*t655)) | ^ Warning: ‘t11’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5170:58: 5170 | + 0.3e1_dp/0.2e1_dp*(t400)*(t405)*(t1566) | ^ Warning: ‘t108’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) | ^ Warning: ‘t106’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5019:30: 5019 | t966 = t136*t105*t108 | ^ Warning: ‘t105’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5151:90: 5151 | *t19 + 12._dp*g3*t1*t24*t32) | ^ Warning: ‘t103’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: 5003 | /0.3e1_dp*t321*t603 + (20._dp*t100*t607)) | ^ Warning: ‘t102’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: Warning: ‘t100’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4740:24: 4740 | t249 = t248*t10 | ^ Warning: ‘t10’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4743:24: 4743 | t256 = t1*ndrho | ^ Warning: ‘t1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5635:90: 5635 | 1.0_dp/Q*(dQrho*dQndrho + d2Qrhondrho) + 1.0_dp/(Q*Q)*dQrho*dQndrho | ^ Warning: ‘dqrho’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3649:76: 3649 | REAL(KIND=dp) :: d2Qndrhondrho, d2Qrhondrho, d2Qrhorho, dQndrho, dQrho, Q, t1, t10, t1004, & | ^ note: ‘dqrho’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:5671:94: 5671 | 1.0_dp/(Q*Q)*(-Q*dQndrho*dQndrho - Q*d2Qndrhondrho + dQndrho*dQndrho) | ^ Warning: ‘dqndrho’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3649:69: 3649 | REAL(KIND=dp) :: d2Qndrhondrho, d2Qrhondrho, d2Qrhorho, dQndrho, dQrho, Q, t1, t10, t1004, & | ^ note: ‘dqndrho’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4430:97: 4430 | e_ndrho_rho = e_ndrho_rho + (-0.4e1_dp/0.3e1_dp*t322*t696 - t80*(t1652 + t1860)*Clda)*sx | ^ Warning: ‘t696’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) | ^ Warning: ‘t691’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: Warning: ‘t690’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4461:36: 4461 | - (4._dp*t568*t570) | ^ Warning: ‘t684’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4461:36: Warning: ‘t681’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: 4376 | *t320 | ^ Warning: ‘t677’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4474:58: 4474 | + 0.3e1_dp/0.2e1_dp*(t511)*(t516)*(t2064) | ^ Warning: ‘t673’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4474:58: Warning: ‘t670’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4474:58: Warning: ‘t664’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4474:58: Warning: ‘t661’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: 4376 | *t320 | ^ Warning: ‘t656’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4487:68: 4487 | *(t1989) - t151*t1979*t83*t159 + (2._dp*t1678*t635) | ^ Warning: ‘t652’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4377:27: 4377 | t1675 = t1241*t651 | ^ Warning: ‘t651’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4487:68: 4487 | *(t1989) - t151*t1979*t83*t159 + (2._dp*t1678*t635) | ^ Warning: ‘t649’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4481:25: 4481 | *(t1886) | ^ Warning: ‘t638’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4383:27: 4383 | t1695 = t1203*t637 | ^ Warning: ‘t637’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4487:68: 4487 | *(t1989) - t151*t1979*t83*t159 + (2._dp*t1678*t635) | ^ Warning: ‘t635’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) | ^ Warning: ‘t629’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4366:26: 4366 | t1645 = t627*t531 | ^ Warning: ‘t627’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4405:26: 4405 | t1781 = t176*t626 | ^ Warning: ‘t626’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) | ^ Warning: ‘t623’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4357:26: 4357 | t1583 = t621*t142 | ^ Warning: ‘t621’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) | ^ Warning: ‘t617’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: Warning: ‘t616’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: Warning: ‘t612’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: 4356 | t419*t77*t871)/0.2e1_dp) | ^ Warning: ‘t611’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: Warning: ‘t610’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) | ^ Warning: ‘t608’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4341:47: 4341 | + t1079*t210*t1080*t316) | ^ Warning: ‘t607’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: 4356 | t419*t77*t871)/0.2e1_dp) | ^ Warning: ‘t604’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: Warning: ‘t599’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: 4338 | *t388) + (2._dp*t374*t227*t592) - (4._dp*t596*t388) | ^ Warning: ‘t596’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) | ^ Warning: ‘t595’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: Warning: ‘t593’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: 4338 | *t388) + (2._dp*t374*t227*t592) - (4._dp*t596*t388) | ^ Warning: ‘t592’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: Warning: ‘t590’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4330:26: 4330 | t1480 = t589*t373 | ^ Warning: ‘t589’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) | ^ Warning: ‘t586’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: Warning: ‘t584’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4461:36: 4461 | - (4._dp*t568*t570) | ^ Warning: ‘t570’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4461:36: Warning: ‘t568’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) | ^ Warning: ‘t567’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4432:111: 4432 | t68 - 2._dp*t561*t317 + 2._dp*t85*t900 - t85*t917) | ^ Warning: ‘t565’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4328:132: 4328 | - t561*t278 + 2._dp*t85*t855 - t85*t872) | ^ Warning: ‘t564’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4328:132: Warning: ‘t561’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4324:64: 4324 | - t80*(t1189 + t1408)*Clda)*sx | ^ Warning: ‘t555’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: 4376 | *t320 | ^ Warning: ‘t550’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) | ^ Warning: ‘t549’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4312:27: 4312 | t1402 = t548*t1401 | ^ Warning: ‘t548’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) | ^ Warning: ‘t546’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: Warning: ‘t545’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4309:30: 4309 | t1393 = t75/t544/t199 | ^ Warning: ‘t544’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4248:21: 4248 | *t58 | ^ Warning: ‘t539’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4429:71: 4429 | *t461*t320) - (2._dp*t91*t344*t875) | ^ Warning: ‘t538’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: 4322 | *t199*t285 + t550*t285)) | ^ Warning: ‘t537’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: 4376 | *t320 | ^ Warning: ‘t534’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: Warning: ‘t533’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4461:36: 4461 | - (4._dp*t568*t570) | ^ Warning: ‘t532’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4474:58: 4474 | + 0.3e1_dp/0.2e1_dp*(t511)*(t516)*(t2064) | ^ Warning: ‘t531’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: 4376 | *t320 | ^ Warning: ‘t528’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: 4322 | *t199*t285 + t550*t285)) | ^ Warning: ‘t526’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: 4376 | *t320 | ^ Warning: ‘t523’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: 4322 | *t199*t285 + t550*t285)) | ^ Warning: ‘t521’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4278:38: 4278 | (t511)*(t516)*(t1260) | ^ Warning: ‘t517’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4487:68: 4487 | *(t1989) - t151*t1979*t83*t159 + (2._dp*t1678*t635) | ^ Warning: ‘t516’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4419:65: 4419 | *t1739 + 0.3e1_dp/0.2e1_dp*(t511)*(t516)*(t1712) | ^ Warning: ‘t513’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4295:78: 4295 | t478*t512*t969) | ^ Warning: ‘t512’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4278:38: 4278 | (t511)*(t516)*(t1260) | ^ Warning: ‘t511’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4278:38: Warning: ‘t505’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4481:25: 4481 | *(t1886) | ^ Warning: ‘t504’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4412:70: 4412 | t1796*t1762 + 0.5e1_dp/0.2e1_dp*(t499)*(t504)*(t1632) | ^ Warning: ‘t501’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4305:31: 4305 | *(t457)*(t933) | ^ Warning: ‘t500’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4278:38: 4278 | (t511)*(t516)*(t1260) | ^ Warning: ‘t499’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: 4376 | *t320 | ^ Warning: ‘t493’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: 4322 | *t199*t285 + t550*t285)) | ^ Warning: ‘t490’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4404:124: 4404 | *t471*t875)/0.2e1_dp + (10._dp*t1685*t1762) | ^ Warning: ‘t486’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4263:27: 4263 | t1242 = t1241*t485 | ^ Warning: ‘t485’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4391:81: 4391 | + 0.3e1_dp/0.2e1_dp*t478*t484*t1712 - 0.2e1_dp*t478*t512*(t1446) | ^ Warning: ‘t484’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4474:58: 4474 | + 0.3e1_dp/0.2e1_dp*(t511)*(t516)*(t2064) | ^ Warning: ‘t483’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4404:124: 4404 | *t471*t875)/0.2e1_dp + (10._dp*t1685*t1762) | ^ Warning: ‘t480’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4487:68: 4487 | *(t1989) - t151*t1979*t83*t159 + (2._dp*t1678*t635) | ^ Warning: ‘t479’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4391:81: 4391 | + 0.3e1_dp/0.2e1_dp*t478*t484*t1712 - 0.2e1_dp*t478*t512*(t1446) | ^ Warning: ‘t478’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4295:78: 4295 | t478*t512*t969) | ^ Warning: ‘t471’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4391:81: 4391 | + 0.3e1_dp/0.2e1_dp*t478*t484*t1712 - 0.2e1_dp*t478*t512*(t1446) | ^ Warning: ‘t470’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4295:78: 4295 | t478*t512*t969) | ^ Warning: ‘t466’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4391:81: 4391 | + 0.3e1_dp/0.2e1_dp*t478*t484*t1712 - 0.2e1_dp*t478*t512*(t1446) | ^ Warning: ‘t463’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4252:27: 4252 | t1204 = t1203*t462 | ^ Warning: ‘t462’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4429:71: 4429 | *t461*t320) - (2._dp*t91*t344*t875) | ^ Warning: ‘t461’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4404:124: 4404 | *t471*t875)/0.2e1_dp + (10._dp*t1685*t1762) | ^ Warning: ‘t457’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4397:32: 4397 | t1762 = t456*t168*t1687 | ^ Warning: ‘t456’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4391:81: 4391 | + 0.3e1_dp/0.2e1_dp*t478*t484*t1712 - 0.2e1_dp*t478*t512*(t1446) | ^ Warning: ‘t453’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4305:31: 4305 | *(t457)*(t933) | ^ Warning: ‘t452’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4481:25: 4481 | *(t1886) | ^ Warning: ‘t451’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4429:71: 4429 | *t461*t320) - (2._dp*t91*t344*t875) | ^ Warning: ‘t445’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4364:26: 4364 | t1627 = t627*t444 | ^ Warning: ‘t444’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: 4376 | *t320 | ^ Warning: ‘t442’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4297:26: 4297 | t1350 = t151*t441 | ^ Warning: ‘t441’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4360:49: 4360 | 0.7e1_dp/0.2e1_dp*t435*t437*t875 | ^ Warning: ‘t438’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4360:49: Warning: ‘t437’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4360:49: Warning: ‘t435’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4216:26: 4216 | t1143 = t433*t142 | ^ Warning: ‘t433’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: 4356 | t419*t77*t871)/0.2e1_dp) | ^ Warning: ‘t429’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: Warning: ‘t428’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: Warning: ‘t424’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: 4234 | *(t435)*(t437)*(t976) | ^ Warning: ‘t423’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: 4356 | t419*t77*t871)/0.2e1_dp) | ^ Warning: ‘t422’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: Warning: ‘t420’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: 4164 | - t249*t210*t872 | ^ Warning: ‘t419’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: 4234 | *(t435)*(t437)*(t976) | ^ Warning: ‘t418’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: Warning: ‘t417’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: Warning: ‘t416’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: Warning: ‘t408’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: Warning: ‘t406’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: Warning: ‘t405’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4210:31: 4210 | t1101 = t125*t404*t129 | ^ Warning: ‘t404’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: 4234 | *(t435)*(t437)*(t976) | ^ Warning: ‘t403’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4341:47: 4341 | + t1079*t210*t1080*t316) | ^ Warning: ‘t401’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: 4234 | *(t435)*(t437)*(t976) | ^ Warning: ‘t400’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: Warning: ‘t399’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: Warning: ‘t397’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4205:30: 4205 | t1065 = t96*t115*t391 | ^ Warning: ‘t391’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: 4338 | *t388) + (2._dp*t374*t227*t592) - (4._dp*t596*t388) | ^ Warning: ‘t388’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: Warning: ‘t384’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4112:23: 4112 | t713 = t4*t381 | ^ Warning: ‘t381’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4203:65: 4203 | t380*t705*t14*t383 + 0.6e1_dp*t118*t119*t718*t77 | ^ Warning: ‘t380’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: 4338 | *t388) + (2._dp*t374*t227*t592) - (4._dp*t596*t388) | ^ Warning: ‘t379’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: Warning: ‘t377’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4203:65: 4203 | t380*t705*t14*t383 + 0.6e1_dp*t118*t119*t718*t77 | ^ Warning: ‘t376’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) | ^ Warning: ‘t375’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4203:65: 4203 | t380*t705*t14*t383 + 0.6e1_dp*t118*t119*t718*t77 | ^ Warning: ‘t374’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4330:26: 4330 | t1480 = t589*t373 | ^ Warning: ‘t373’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4203:65: 4203 | t380*t705*t14*t383 + 0.6e1_dp*t118*t119*t718*t77 | ^ Warning: ‘t370’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: 4338 | *t388) + (2._dp*t374*t227*t592) - (4._dp*t596*t388) | ^ Warning: ‘t369’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: 4356 | t419*t77*t871)/0.2e1_dp) | ^ Warning: ‘t365’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: 4234 | *(t435)*(t437)*(t976) | ^ Warning: ‘t364’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4187:24: 4187 | t967 = t361*t82 | ^ Warning: ‘t361’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: 4356 | t419*t77*t871)/0.2e1_dp) | ^ Warning: ‘t359’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: Warning: ‘t352’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4429:71: 4429 | *t461*t320) - (2._dp*t91*t344*t875) | ^ Warning: ‘t345’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4248:21: 4248 | *t58 | ^ Warning: ‘t344’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4429:71: 4429 | *t461*t320) - (2._dp*t91*t344*t875) | ^ Warning: ‘t342’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: 4356 | t419*t77*t871)/0.2e1_dp) | ^ Warning: ‘t341’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4328:132: 4328 | - t561*t278 + 2._dp*t85*t855 - t85*t872) | ^ Warning: ‘t339’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4186:132: 4186 | *t759*t68 - 2._dp*t335*t278 + 2._dp*t85*t769 - t85*t804)) | ^ Warning: ‘t338’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4328:132: 4328 | - t561*t278 + 2._dp*t85*t855 - t85*t872) | ^ Warning: ‘t335’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4328:132: Warning: ‘t332’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4328:132: Warning: ‘t329’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4186:132: 4186 | *t759*t68 - 2._dp*t335*t278 + 2._dp*t85*t769 - t85*t804)) | ^ Warning: ‘t328’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4429:71: 4429 | *t461*t320) - (2._dp*t91*t344*t875) | ^ Warning: ‘t325’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4430:97: 4430 | e_ndrho_rho = e_ndrho_rho + (-0.4e1_dp/0.3e1_dp*t322*t696 - t80*(t1652 + t1860)*Clda)*sx | ^ Warning: ‘t322’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4391:81: 4391 | + 0.3e1_dp/0.2e1_dp*t478*t484*t1712 - 0.2e1_dp*t478*t512*(t1446) | ^ Warning: ‘t320’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4177:26: 4177 | *t210*t917 | ^ Warning: ‘t318’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4432:111: 4432 | t68 - 2._dp*t561*t317 + 2._dp*t85*t900 - t85*t917) | ^ Warning: ‘t317’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4341:47: 4341 | + t1079*t210*t1080*t316) | ^ Warning: ‘t316’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: 4157 | (48._dp*t313*t274) | ^ Warning: ‘t313’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: Warning: ‘t309’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: Warning: ‘t308’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: Warning: ‘t305’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: Warning: ‘t304’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4177:26: 4177 | *t210*t917 | ^ Warning: ‘t302’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: 4164 | - t249*t210*t872 | ^ Warning: ‘t301’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4342:26: 4342 | t1562 = t300*t251 | ^ Warning: ‘t300’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4151:72: 4151 | - 0.16e2_dp/0.3e1_dp*t296*t235*t238 - (16._dp*t297*t242) | ^ Warning: ‘t297’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4151:72: Warning: ‘t296’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4173:30: 4173 | a5*t21*t54*t65 | ^ Warning: ‘t295’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4151:72: 4151 | - 0.16e2_dp/0.3e1_dp*t296*t235*t238 - (16._dp*t297*t242) | ^ Warning: ‘t292’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4151:72: Warning: ‘t291’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: 4164 | - t249*t210*t872 | ^ Warning: ‘t288’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4153:24: 4153 | t849 = t287*t18 | ^ Warning: ‘t287’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: 4376 | *t320 | ^ Warning: ‘t285’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: 4164 | - t249*t210*t872 | ^ Warning: ‘t279’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4328:132: 4328 | - t561*t278 + 2._dp*t85*t855 - t85*t872) | ^ Warning: ‘t278’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: 4234 | *(t435)*(t437)*(t976) | ^ Warning: ‘t277’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: 4157 | (48._dp*t313*t274) | ^ Warning: ‘t274’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: Warning: ‘t268’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: 4141 | t63) | ^ Warning: ‘t266’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: 4157 | (48._dp*t313*t274) | ^ Warning: ‘t262’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: 4141 | t63) | ^ Warning: ‘t261’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: Warning: ‘t260’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: 4157 | (48._dp*t313*t274) | ^ Warning: ‘t259’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: 4376 | *t320 | ^ Warning: ‘t258’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: 4141 | t63) | ^ Warning: ‘t252’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4342:26: 4342 | t1562 = t300*t251 | ^ Warning: ‘t251’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4132:33: 4132 | t767 = 0.1e1_dp/t250/t67 | ^ Warning: ‘t250’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4143:30: 4143 | t806 = t249*t210*t804 | ^ Warning: ‘t249’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: 4164 | - t249*t210*t872 | ^ Warning: ‘t247’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4117:35: 4117 | t724 = 4._dp*t11*t218*t246 | ^ Warning: ‘t246’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4214:26: 4214 | t1121 = t245*t251 | ^ Warning: ‘t245’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: 4157 | (48._dp*t313*t274) | ^ Warning: ‘t242’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: Warning: ‘t238’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4122:25: 4122 | t748 = t237*t231 | ^ Warning: ‘t237’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4128:83: 4128 | *t25*t756) | ^ Warning: ‘t236’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: 4157 | (48._dp*t313*t274) | ^ Warning: ‘t235’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4248:21: 4248 | *t58 | ^ Warning: ‘t234’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4151:72: 4151 | - 0.16e2_dp/0.3e1_dp*t296*t235*t238 - (16._dp*t297*t242) | ^ Warning: ‘t228’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: 4338 | *t388) + (2._dp*t374*t227*t592) - (4._dp*t596*t388) | ^ Warning: ‘t227’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4151:72: 4151 | - 0.16e2_dp/0.3e1_dp*t296*t235*t238 - (16._dp*t297*t242) | ^ Warning: ‘t224’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4128:83: 4128 | *t25*t756) | ^ Warning: ‘t223’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: 4234 | *(t435)*(t437)*(t976) | ^ Warning: ‘t222’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: 4164 | - t249*t210*t872 | ^ Warning: ‘t219’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: 4234 | *(t435)*(t437)*(t976) | ^ Warning: ‘t218’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: 4322 | *t199*t285 + t550*t285)) | ^ Warning: ‘t217’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4120:34: 4120 | t743 = t56*r3*t58*t5*t216 | ^ Warning: ‘t216’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: 4164 | - t249*t210*t872 | ^ Warning: ‘t213’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: Warning: ‘t212’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4135:36: 4135 | t772 = 2._dp*t249*t210*t769 | ^ Warning: ‘t210’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: 4164 | - t249*t210*t872 | ^ Warning: ‘t209’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4147:25: 4147 | t813 = t287*t208 | ^ Warning: ‘t208’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4419:65: 4419 | *t1739 + 0.3e1_dp/0.2e1_dp*(t511)*(t516)*(t1712) | ^ Warning: ‘t95’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) | ^ Warning: ‘t94’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4474:58: 4474 | + 0.3e1_dp/0.2e1_dp*(t511)*(t516)*(t2064) | ^ Warning: ‘t93’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: 4234 | *(t435)*(t437)*(t976) | ^ Warning: ‘t92’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: 4322 | *t199*t285 + t550*t285)) | ^ Warning: ‘t91’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4261:30: 4261 | t1240 = t180*t90*t149 | ^ Warning: ‘t90’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4136:32: 4136 | t781 = 0.1e1_dp/t9/t743 | ^ Warning: ‘t9’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4045:41: 4045 | t567 = 2._dp*t288*t88 + t11*t565 | ^ Warning: ‘t88’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4186:132: 4186 | *t759*t68 - 2._dp*t335*t278 + 2._dp*t85*t769 - t85*t804)) | ^ Warning: ‘t87’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4432:111: 4432 | t68 - 2._dp*t561*t317 + 2._dp*t85*t900 - t85*t917) | ^ Warning: ‘t85’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4391:81: 4391 | + 0.3e1_dp/0.2e1_dp*t478*t484*t1712 - 0.2e1_dp*t478*t512*(t1446) | ^ Warning: ‘t84’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4487:68: 4487 | *(t1989) - t151*t1979*t83*t159 + (2._dp*t1678*t635) | ^ Warning: ‘t83’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3927:24: 3927 | t352 = t82*t325 | ^ Warning: ‘t82’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4495:71: 4495 | e_ndrho_ndrho = e_ndrho_ndrho + (-t80*(t2013 + t2174)*Clda)*sx | ^ Warning: ‘t80’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4121:27: 4121 | t746 = t24/t8/t743 | ^ Warning: ‘t8’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4179:22: 4179 | t922 = t78**2 | ^ Warning: ‘t78’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4310:23: 4310 | t1400 = t75**2 | ^ Warning: ‘t75’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4145:67: 4145 | + t772 - t806 + 0.10e2_dp/0.9e1_dp*t73*t258*t56*t58 | ^ Warning: ‘t73’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4181:64: 4181 | + t772 - t806 + 0.10e2_dp/0.9e1_dp*t72*t258*t231 | ^ Warning: ‘t72’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3912:53: 3912 | t320 = 2._dp*t288*t70 + t11*t302 - t249*t318 | ^ Warning: ‘t70’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4116:34: 4116 | t721 = 6._dp*t11*t718*t69 | ^ Warning: ‘t69’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4055:25: 4055 | t595 = t68*ndrho | ^ Warning: ‘t68’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3875:22: 3875 | t250 = t67**2 | ^ Warning: ‘t67’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4173:30: 4173 | a5*t21*t54*t65 | ^ Warning: ‘t65’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: 4141 | t63) | ^ Warning: ‘t63’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3885:31: 3885 | t274 = t60/t61/rho*t63 | ^ Warning: ‘t61’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: 4141 | t63) | ^ Warning: ‘t55’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4173:30: 4173 | a5*t21*t54*t65 | ^ Warning: ‘t49’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: 4141 | t63) | ^ Warning: ‘t48’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4123:26: 4123 | t752 = t46*t31*t6 | ^ Warning: ‘t46’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: 4322 | *t199*t285 + t550*t285)) | ^ Warning: ‘t44’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: 4141 | t63) | ^ Warning: ‘t42’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4197:33: 4197 | t1032 = t116*t251*t4*t44 | ^ Warning: ‘t4’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: 4141 | t63) | ^ Warning: ‘t39’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3908:26: 3908 | t313 = a5*t38*t54 | ^ Warning: ‘t38’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: 4141 | t63) | ^ Warning: ‘t36’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: Warning: ‘t35’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4215:25: 4215 | t1124 = t34*t767 | ^ Warning: ‘t34’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4173:30: 4173 | a5*t21*t54*t65 | ^ Warning: ‘t32’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4124:28: 4124 | t756 = t27*t266*t31 | ^ Warning: ‘t31’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4128:83: 4128 | *t25*t756) | ^ Warning: ‘t29’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: 4141 | t63) | ^ Warning: ‘t28’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4124:28: 4124 | t756 = t27*t266*t31 | ^ Warning: ‘t27’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4128:83: 4128 | *t25*t756) | ^ Warning: ‘t25’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4128:83: Warning: ‘t22’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4173:30: 4173 | a5*t21*t54*t65 | ^ Warning: ‘t21’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4324:64: 4324 | - t80*(t1189 + t1408)*Clda)*sx | ^ Warning: ‘t206’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) | ^ Warning: ‘t200’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: Warning: ‘t199’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4461:36: 4461 | - (4._dp*t568*t570) | ^ Warning: ‘t195’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: 4322 | *t199*t285 + t550*t285)) | ^ Warning: ‘t194’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: Warning: ‘t193’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) | ^ Warning: ‘t190’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: 4338 | *t388) + (2._dp*t374*t227*t592) - (4._dp*t596*t388) | ^ Warning: ‘t19’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: 4322 | *t199*t285 + t550*t285)) | ^ Warning: ‘t186’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) | ^ Warning: ‘t185’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4289:26: 4289 | t1331 = t166*t181 | ^ Warning: ‘t181’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) | ^ Warning: ‘t18’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4406:26: 4406 | t1796 = t176*t177 | ^ Warning: ‘t177’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4248:21: 4248 | *t58 | ^ Warning: ‘t174’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4487:68: 4487 | *(t1989) - t151*t1979*t83*t159 + (2._dp*t1678*t635) | ^ Warning: ‘t170’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4128:83: 4128 | *t25*t756) | ^ Warning: ‘t17’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4264:40: 4264 | t1250 = 0.1e1_dp/t169/t156/t155 | ^ Warning: ‘t169’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4429:71: 4429 | *t461*t320) - (2._dp*t91*t344*t875) | ^ Warning: ‘t168’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4393:26: 4393 | t1737 = t166*t167 | ^ Warning: ‘t167’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4404:124: 4404 | *t471*t875)/0.2e1_dp + (10._dp*t1685*t1762) | ^ Warning: ‘t163’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4286:35: 4286 | t1315 = 0.1e1_dp/t162/t155 | ^ Warning: ‘t162’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4128:83: 4128 | *t25*t756) | ^ Warning: ‘t16’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: 4376 | *t320 | ^ Warning: ‘t159’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4254:41: 4254 | t1213 = 0.1e1_dp/t158/t1210/t155 | ^ Warning: ‘t158’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3985:34: 3985 | t456 = 0.1e1_dp/t158/t157 | ^ Warning: ‘t157’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4396:32: 4396 | t1753 = t456*t156*t1687 | ^ Warning: ‘t156’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4382:32: 4382 | t1692 = t483*t155*t1687 | ^ Warning: ‘t155’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4394:32: 4394 | t1739 = t483*t154*t1687 | ^ Warning: ‘t154’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4379:26: 4379 | t1685 = t151*t152 | ^ Warning: ‘t152’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: 4234 | *(t435)*(t437)*(t976) | ^ Warning: ‘t15’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4474:58: 4474 | + 0.3e1_dp/0.2e1_dp*(t511)*(t516)*(t2064) | ^ Warning: ‘t149’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4281:26: 4281 | t1295 = t148*t968 | ^ Warning: ‘t148’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4250:31: 4250 | t1202 = t176*t147*t149 | ^ Warning: ‘t147’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) | ^ Warning: ‘t145’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3974:25: 3974 | t435 = t141*t142 | ^ Warning: ‘t141’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4328:132: 4328 | - t561*t278 + 2._dp*t85*t855 - t85*t872) | ^ Warning: ‘t14’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) | ^ Warning: ‘t136’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: 4356 | t419*t77*t871)/0.2e1_dp) | ^ Warning: ‘t133’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: Warning: ‘t132’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: 4234 | *(t435)*(t437)*(t976) | ^ Warning: ‘t131’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: Warning: ‘t13’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: 4356 | t419*t77*t871)/0.2e1_dp) | ^ Warning: ‘t129’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) | ^ Warning: ‘t128’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: 4234 | *(t435)*(t437)*(t976) | ^ Warning: ‘t127’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3961:30: 3961 | t416 = t125*t126*t128 | ^ Warning: ‘t125’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4206:25: 4206 | t1068 = t96*t124 | ^ Warning: ‘t124’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) | ^ Warning: ‘t123’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: Warning: ‘t121’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: 4338 | *t388) + (2._dp*t374*t227*t592) - (4._dp*t596*t388) | ^ Warning: ‘t120’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3851:23: 3851 | t216 = t12*rho | ^ Warning: ‘t12’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4341:47: 4341 | + t1079*t210*t1080*t316) | ^ Warning: ‘t119’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4203:65: 4203 | t380*t705*t14*t383 + 0.6e1_dp*t118*t119*t718*t77 | ^ Warning: ‘t118’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) | ^ Warning: ‘t117’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: Warning: ‘t116’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: Warning: ‘t113’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3931:30: 3931 | t364 = t109/t110/t361 | ^ Warning: ‘t110’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4186:132: 4186 | *t759*t68 - 2._dp*t335*t278 + 2._dp*t85*t769 - t85*t804)) | ^ Warning: ‘t11’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: 4234 | *(t435)*(t437)*(t976) | ^ Warning: ‘t108’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:4128:83: 4128 | *t25*t756) | ^ Warning: ‘t10’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3898:24: 3898 | t295 = t1*ndrho | ^ Warning: ‘t1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3535:89: 3535 | t2274)*Clda)*sx | ^ Warning: ‘t920’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) | ^ Warning: ‘t917’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: Warning: ‘t903’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3476:44: 3476 | - t852*t519 + f12*t2053*t94 | ^ Warning: ‘t886’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3453:132: 3453 | *t407) | ^ Warning: ‘t875’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: 3533 | - (5._dp*t1726*t506*t6*t407) | ^ Warning: ‘t860’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3476:44: 3476 | - t852*t519 + f12*t2053*t94 | ^ Warning: ‘t852’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) | ^ Warning: ‘t839’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: Warning: ‘t833’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) | ^ Warning: ‘t823’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: Warning: ‘t822’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: 3559 | *t1139 - t243*t2336)*alpha6*t247*t249 | ^ Warning: ‘t816’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: Warning: ‘t813’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3476:44: 3476 | - t852*t519 + f12*t2053*t94 | ^ Warning: ‘t809’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3583:92: 3583 | t2511) + 0.3e1_dp/0.2e1_dp*(t474)*(t481)*(t2515) | ^ Warning: ‘t805’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3583:92: Warning: ‘t802’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3583:92: Warning: ‘t796’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3583:92: Warning: ‘t793’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: 3533 | - (5._dp*t1726*t506*t6*t407) | ^ Warning: ‘t788’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3595:43: 3595 | /0.4e1_dp*t603*t1469*t2473 | ^ Warning: ‘t784’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3498:27: 3498 | t2136 = t1332*t783 | ^ Warning: ‘t783’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3595:43: 3595 | /0.4e1_dp*t603*t1469*t2473 | ^ Warning: ‘t781’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3589:104: 3589 | *t81*t1430*t2279) - (t81*t93*t595*t2279) | ^ Warning: ‘t770’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3478:27: 3478 | t2066 = t1262*t769 | ^ Warning: ‘t769’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3589:104: 3589 | *t81*t1430*t2279) - (t81*t93*t595*t2279) | ^ Warning: ‘t767’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: 3559 | *t1139 - t243*t2336)*alpha6*t247*t249 | ^ Warning: ‘t761’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3477:26: 3477 | t2060 = t759*t513 | ^ Warning: ‘t759’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3507:26: 3507 | t2180 = t136*t758 | ^ Warning: ‘t758’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3567:93: 3567 | t3*t19 + 12._dp*g3*t1*t24*t32) | ^ Warning: ‘t756’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: 3459 | - (16._dp*t752*t331)) | ^ Warning: ‘t755’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: Warning: ‘t752’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: Warning: ‘t751’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: Warning: ‘t748’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: Warning: ‘t747’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: 3559 | *t1139 - t243*t2336)*alpha6*t247*t249 | ^ Warning: ‘t742’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: Warning: ‘t740’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3515:26: 3515 | t2211 = t140*t739 | ^ Warning: ‘t739’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3544:115: 3544 | *t68 - 2._dp*t733*t404 + 2._dp*t85*t1119 - t85*t1136) | ^ Warning: ‘t737’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3471:93: 3471 | t404 - t733*t365 + 2._dp*t85*t1073 - t85*t1090) | ^ Warning: ‘t736’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3471:93: Warning: ‘t733’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3411:85: 3411 | t727 - t80*(t1392 + t1517 + t1577 + t1742)*Clda)*sx | ^ Warning: ‘t727’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: 3364 | *t58 | ^ Warning: ‘t723’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) | ^ Warning: ‘t714’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: 3409 | *t234*t1737*t452) | ^ Warning: ‘t710’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3385:26: 3385 | t1671 = t709*t160 | ^ Warning: ‘t709’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: 3364 | *t58 | ^ Warning: ‘t705’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 | ^ Warning: ‘t702’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) | ^ Warning: ‘t699’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 | ^ Warning: ‘t697’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: Warning: ‘t695’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3476:44: 3476 | - t852*t519 + f12*t2053*t94 | ^ Warning: ‘t692’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) | ^ Warning: ‘t689’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: 3409 | *t234*t1737*t452) | ^ Warning: ‘t687’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: 3364 | *t58 | ^ Warning: ‘t681’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: Warning: ‘t679’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 | ^ Warning: ‘t671’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3247:26: 3247 | t1186 = t670*t186 | ^ Warning: ‘t670’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) | ^ Warning: ‘t665’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: Warning: ‘t660’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: 3409 | *t234*t1737*t452) | ^ Warning: ‘t659’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3583:92: 3583 | t2511) + 0.3e1_dp/0.2e1_dp*(t474)*(t481)*(t2515) | ^ Warning: ‘t658’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: 3409 | *t234*t1737*t452) | ^ Warning: ‘t656’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3453:132: 3453 | *t407) | ^ Warning: ‘t652’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3348:34: 3348 | (4._dp*t510*t552) | ^ Warning: ‘t650’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: 3409 | *t234*t1737*t452) | ^ Warning: ‘t644’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3348:34: 3348 | (4._dp*t510*t552) | ^ Warning: ‘t641’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: 3409 | *t234*t1737*t452) | ^ Warning: ‘t638’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3453:132: 3453 | *t407) | ^ Warning: ‘t635’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: 3533 | - (5._dp*t1726*t506*t6*t407) | ^ Warning: ‘t634’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: 3409 | *t234*t1737*t452) | ^ Warning: ‘t633’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3453:132: 3453 | *t407) | ^ Warning: ‘t629’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3351:26: 3351 | t1545 = t628*t238 | ^ Warning: ‘t628’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) | ^ Warning: ‘t626’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3453:132: 3453 | *t407) | ^ Warning: ‘t622’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: 3364 | *t58 | ^ Warning: ‘t620’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3453:132: 3453 | *t407) | ^ Warning: ‘t615’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: 3364 | *t58 | ^ Warning: ‘t612’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3496:32: 3496 | *(t607)*(t2111) | ^ Warning: ‘t608’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3595:43: 3595 | /0.4e1_dp*t603*t1469*t2473 | ^ Warning: ‘t607’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3496:32: 3496 | *(t607)*(t2111) | ^ Warning: ‘t605’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3339:60: 3339 | *t1333) | ^ Warning: ‘t604’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3595:43: 3595 | /0.4e1_dp*t603*t1469*t2473 | ^ Warning: ‘t603’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3339:60: 3339 | *t1333) | ^ Warning: ‘t596’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3506:55: 3506 | *t585 - 0.27e2_dp/0.4e1_dp*t2069*t2155 | ^ Warning: ‘t595’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3339:60: 3339 | *t1333) | ^ Warning: ‘t591’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3506:55: 3506 | *t585 - 0.27e2_dp/0.4e1_dp*t2069*t2155 | ^ Warning: ‘t588’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3327:85: 3327 | *t1430*t1151) - t1434*t1435*t452 | ^ Warning: ‘t587’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3506:55: 3506 | *t585 - 0.27e2_dp/0.4e1_dp*t2069*t2155 | ^ Warning: ‘t585’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3327:85: 3327 | *t1430*t1151) - t1434*t1435*t452 | ^ Warning: ‘t584’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3589:104: 3589 | *t81*t1430*t2279) - (t81*t93*t595*t2279) | ^ Warning: ‘t583’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3348:34: 3348 | (4._dp*t510*t552) | ^ Warning: ‘t577’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3413:26: 3413 | t1768 = t569*t407 | ^ Warning: ‘t569’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: 3409 | *t234*t1737*t452) | ^ Warning: ‘t566’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: Warning: ‘t565’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: Warning: ‘t561’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3390:26: 3390 | t1732 = t558*t513 | ^ Warning: ‘t558’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) | ^ Warning: ‘t552’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 | ^ Warning: ‘t551’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3348:34: 3348 | (4._dp*t510*t552) | ^ Warning: ‘t549’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3538:27: 3538 | t2283 = t541*t1139 | ^ Warning: ‘t541’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3381:69: 3381 | - 0.3e1_dp/0.4e1_dp*t243*t1159 + t243*t1162/0.2e1_dp | ^ Warning: ‘t536’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3467:44: 3467 | t1785 + t243*t1788/0.2e1_dp | ^ Warning: ‘t535’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3417:26: 3417 | t1791 = t531*t407 | ^ Warning: ‘t531’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3381:69: 3381 | - 0.3e1_dp/0.4e1_dp*t243*t1159 + t243*t1162/0.2e1_dp | ^ Warning: ‘t530’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3381:69: Warning: ‘t524’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3387:30: 3387 | t1691 = 0.1e1_dp/t523 | ^ Warning: ‘t523’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3371:26: 3371 | t1619 = t522*t220 | ^ Warning: ‘t522’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3476:44: 3476 | - t852*t519 + f12*t2053*t94 | ^ Warning: ‘t519’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: 3533 | - (5._dp*t1726*t506*t6*t407) | ^ Warning: ‘t516’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: 3409 | *t234*t1737*t452) | ^ Warning: ‘t514’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3477:26: 3477 | t2060 = t759*t513 | ^ Warning: ‘t513’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3235:34: 3235 | t1149 = 0.1e1_dp/t512/t82 | ^ Warning: ‘t512’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3453:132: 3453 | *t407) | ^ Warning: ‘t510’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: 3533 | - (5._dp*t1726*t506*t6*t407) | ^ Warning: ‘t507’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: Warning: ‘t506’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3348:34: 3348 | (4._dp*t510*t552) | ^ Warning: ‘t505’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: 3364 | *t58 | ^ Warning: ‘t503’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: Warning: ‘t496’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: 3533 | - (5._dp*t1726*t506*t6*t407) | ^ Warning: ‘t491’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 | ^ Warning: ‘t489’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: 3409 | *t234*t1737*t452) | ^ Warning: ‘t487’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3296:39: 3296 | *(t474)*(t481)*(t1351) | ^ Warning: ‘t483’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3281:27: 3281 | t1333 = t1332*t482 | ^ Warning: ‘t482’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3595:43: 3595 | /0.4e1_dp*t603*t1469*t2473 | ^ Warning: ‘t481’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3583:92: 3583 | t2511) + 0.3e1_dp/0.2e1_dp*(t474)*(t481)*(t2515) | ^ Warning: ‘t480’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3521:65: 3521 | *t2072 + 0.3e1_dp/0.2e1_dp*(t474)*(t481)*(t2111) | ^ Warning: ‘t476’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3339:60: 3339 | *t1333) | ^ Warning: ‘t475’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3296:39: 3296 | *(t474)*(t481)*(t1351) | ^ Warning: ‘t474’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3330:26: 3330 | t1453 = t125*t470 | ^ Warning: ‘t470’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3471:93: 3471 | t404 - t733*t365 + 2._dp*t85*t1073 - t85*t1090) | ^ Warning: ‘t468’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3276:132: 3276 | *t979*t68 - 2._dp*t464*t365 + 2._dp*t85*t989 - t85*t1022)) | ^ Warning: ‘t467’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3471:93: 3471 | t404 - t733*t365 + 2._dp*t85*t1073 - t85*t1090) | ^ Warning: ‘t464’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3471:93: Warning: ‘t461’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3471:93: Warning: ‘t458’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3276:132: 3276 | *t979*t68 - 2._dp*t464*t365 + 2._dp*t85*t989 - t85*t1022)) | ^ Warning: ‘t457’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3296:39: 3296 | *(t474)*(t481)*(t1351) | ^ Warning: ‘t454’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) | ^ Warning: ‘t453’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3506:55: 3506 | *t585 - 0.27e2_dp/0.4e1_dp*t2069*t2155 | ^ Warning: ‘t452’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3589:104: 3589 | *t81*t1430*t2279) - (t81*t93*t595*t2279) | ^ Warning: ‘t448’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3486:32: 3486 | t2099 = t447*t127*t2071 | ^ Warning: ‘t447’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3514:70: 3514 | t2195*t2099 + 0.5e1_dp/0.2e1_dp*(t440)*(t448)*(t1946) | ^ Warning: ‘t443’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: 3533 | - (5._dp*t1726*t506*t6*t407) | ^ Warning: ‘t442’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: Warning: ‘t441’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3296:39: 3296 | *(t474)*(t481)*(t1351) | ^ Warning: ‘t440’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3316:26: 3316 | t1407 = t110*t436 | ^ Warning: ‘t436’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: 3459 | - (16._dp*t752*t331)) | ^ Warning: ‘t434’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: 3254 | /0.3e1_dp*t428*t972 + (20._dp*t100*t976)) | ^ Warning: ‘t433’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: Warning: ‘t428’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: Warning: ‘t423’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: 3459 | - (16._dp*t752*t331)) | ^ Warning: ‘t420’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: Warning: ‘t417’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: 3254 | /0.3e1_dp*t428*t972 + (20._dp*t100*t976)) | ^ Warning: ‘t416’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: 3533 | - (5._dp*t1726*t506*t6*t407) | ^ Warning: ‘t413’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3535:89: 3535 | t2274)*Clda)*sx | ^ Warning: ‘t409’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3506:55: 3506 | *t585 - 0.27e2_dp/0.4e1_dp*t2069*t2155 | ^ Warning: ‘t407’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3232:46: 3232 | *t303*t1119 - t338*t303*t1136 | ^ Warning: ‘t405’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3544:115: 3544 | *t68 - 2._dp*t733*t404 + 2._dp*t85*t1119 - t85*t1136) | ^ Warning: ‘t404’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: 3222 | *t303*t1073 - t338*t303*t1090 | ^ Warning: ‘t403’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: 3216 | *t355) - (48._dp*t400*t361)) | ^ Warning: ‘t400’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: Warning: ‘t396’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: Warning: ‘t395’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: Warning: ‘t392’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: Warning: ‘t391’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3232:46: 3232 | *t303*t1119 - t338*t303*t1136 | ^ Warning: ‘t389’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: 3222 | *t303*t1073 - t338*t303*t1090 | ^ Warning: ‘t388’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3209:25: 3209 | t1034 = t14*t387 | ^ Warning: ‘t387’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3211:73: 3211 | - 0.16e2_dp/0.3e1_dp*t383*t324*t327 - (16._dp*t384*t331) | ^ Warning: ‘t384’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3211:73: Warning: ‘t383’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3229:47: 3229 | + 30._dp*a5*t21*t54*t65) | ^ Warning: ‘t382’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3211:73: 3211 | - 0.16e2_dp/0.3e1_dp*t383*t324*t327 - (16._dp*t384*t331) | ^ Warning: ‘t379’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3211:73: Warning: ‘t378’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: 3222 | *t303*t1073 - t338*t303*t1090 | ^ Warning: ‘t375’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3212:25: 3212 | t1067 = t374*t18 | ^ Warning: ‘t374’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3467:44: 3467 | t1785 + t243*t1788/0.2e1_dp | ^ Warning: ‘t372’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) | ^ Warning: ‘t369’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: 3222 | *t303*t1073 - t338*t303*t1090 | ^ Warning: ‘t366’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3471:93: 3471 | t404 - t733*t365 + 2._dp*t85*t1073 - t85*t1090) | ^ Warning: ‘t365’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3213:31: 3213 | t1073 = t987*t364*t403 | ^ Warning: ‘t364’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: 3216 | *t355) - (48._dp*t400*t361)) | ^ Warning: ‘t361’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: Warning: ‘t355’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: 3202 | /t12*t63)) | ^ Warning: ‘t353’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: 3216 | *t355) - (48._dp*t400*t361)) | ^ Warning: ‘t349’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: 3202 | /t12*t63)) | ^ Warning: ‘t348’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: Warning: ‘t347’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: 3216 | *t355) - (48._dp*t400*t361)) | ^ Warning: ‘t346’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: 3202 | /t12*t63)) | ^ Warning: ‘t341’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3229:47: 3229 | + 30._dp*a5*t21*t54*t65) | ^ Warning: ‘t340’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3194:33: 3194 | t987 = 0.1e1_dp/t339/t67 | ^ Warning: ‘t339’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3203:32: 3203 | t1024 = t338*t303*t1022 | ^ Warning: ‘t338’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: 3222 | *t303*t1073 - t338*t303*t1090 | ^ Warning: ‘t336’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3178:35: 3178 | t950 = 4._dp*t11*t311*t335 | ^ Warning: ‘t335’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3171:24: 3171 | t933 = t14*t334 | ^ Warning: ‘t334’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: 3459 | - (16._dp*t752*t331)) | ^ Warning: ‘t331’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: Warning: ‘t327’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3186:25: 3186 | t968 = t326*t275 | ^ Warning: ‘t326’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3191:64: 3191 | 0.32e2_dp/0.3e1_dp*t325*t972 + (20._dp*t25*t976) | ^ Warning: ‘t325’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: 3459 | - (16._dp*t752*t331)) | ^ Warning: ‘t324’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: Warning: ‘t321’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3179:23: 3179 | t951 = t4*t320 | ^ Warning: ‘t320’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: 3459 | - (16._dp*t752*t331)) | ^ Warning: ‘t317’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3191:64: 3191 | 0.32e2_dp/0.3e1_dp*t325*t972 + (20._dp*t25*t976) | ^ Warning: ‘t316’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: 3459 | - (16._dp*t752*t331)) | ^ Warning: ‘t315’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: 3222 | *t303*t1073 - t338*t303*t1090 | ^ Warning: ‘t312’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: 3254 | /0.3e1_dp*t428*t972 + (20._dp*t100*t976)) | ^ Warning: ‘t311’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3169:27: 3169 | t930 = t4*t44*t310 | ^ Warning: ‘t310’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: 3202 | /t12*t63)) | ^ Warning: ‘t309’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: 3222 | *t303*t1073 - t338*t303*t1090 | ^ Warning: ‘t306’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: Warning: ‘t305’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3197:36: 3197 | t992 = 2._dp*t338*t303*t989 | ^ Warning: ‘t303’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: 3222 | *t303*t1073 - t338*t303*t1090 | ^ Warning: ‘t302’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3208:26: 3208 | t1031 = t374*t301 | ^ Warning: ‘t301’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: 3254 | /0.3e1_dp*t428*t972 + (20._dp*t100*t976)) | ^ Warning: ‘t99’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: Warning: ‘t97’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: Warning: ‘t96’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3521:65: 3521 | *t2072 + 0.3e1_dp/0.2e1_dp*(t474)*(t481)*(t2111) | ^ Warning: ‘t95’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: 3559 | *t1139 - t243*t2336)*alpha6*t247*t249 | ^ Warning: ‘t94’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3583:92: 3583 | t2511) + 0.3e1_dp/0.2e1_dp*(t474)*(t481)*(t2515) | ^ Warning: ‘t93’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3007:22: 3007 | t512 = t92**2 | ^ Warning: ‘t92’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: 3409 | *t234*t1737*t452) | ^ Warning: ‘t91’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3279:30: 3279 | t1331 = t140*t90*t108 | ^ Warning: ‘t90’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: 3364 | *t58 | ^ Warning: ‘t9’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3544:115: 3544 | *t68 - 2._dp*t733*t404 + 2._dp*t85*t1119 - t85*t1136) | ^ Warning: ‘t88’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3276:132: 3276 | *t979*t68 - 2._dp*t464*t365 + 2._dp*t85*t989 - t85*t1022)) | ^ Warning: ‘t87’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3544:115: 3544 | *t68 - 2._dp*t733*t404 + 2._dp*t85*t1119 - t85*t1136) | ^ Warning: ‘t85’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3506:55: 3506 | *t585 - 0.27e2_dp/0.4e1_dp*t2069*t2155 | ^ Warning: ‘t84’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3595:43: 3595 | /0.4e1_dp*t603*t1469*t2473 | ^ Warning: ‘t83’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3235:34: 3235 | t1149 = 0.1e1_dp/t512/t82 | ^ Warning: ‘t82’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3614:71: 3614 | e_ndrho_ndrho = e_ndrho_ndrho + (-t80*(t2391 + t2668)*Clda)*sx | ^ Warning: ‘t80’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 | ^ Warning: ‘t8’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3234:23: 3234 | t1141 = t78**2 | ^ Warning: ‘t78’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3418:30: 3418 | t1795 = t75*t372*t407 | ^ Warning: ‘t75’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3206:62: 3206 | + t992 - t1024 + 0.10e2_dp/0.9e1_dp*t73*t1026 | ^ Warning: ‘t73’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) | ^ Warning: ‘t72’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2957:53: 2957 | t407 = 2._dp*t375*t70 + t11*t389 - t338*t405 | ^ Warning: ‘t70’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3177:34: 3177 | t947 = 6._dp*t11*t944*t69 | ^ Warning: ‘t69’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3544:115: 3544 | *t68 - 2._dp*t733*t404 + 2._dp*t85*t1119 - t85*t1136) | ^ Warning: ‘t68’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2921:22: 2921 | t339 = t67**2 | ^ Warning: ‘t67’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3229:47: 3229 | + 30._dp*a5*t21*t54*t65) | ^ Warning: ‘t65’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: 3202 | /t12*t63)) | ^ Warning: ‘t63’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2930:31: 2930 | t361 = t60/t61/rho*t63 | ^ Warning: ‘t61’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: 3202 | /t12*t63)) | ^ Warning: ‘t55’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3229:47: 3229 | + 30._dp*a5*t21*t54*t65) | ^ Warning: ‘t49’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: 3202 | /t12*t63)) | ^ Warning: ‘t48’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3187:26: 3187 | t972 = t46*t31*t6 | ^ Warning: ‘t46’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: 3409 | *t234*t1737*t452) | ^ Warning: ‘t44’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: 3202 | /t12*t63)) | ^ Warning: ‘t42’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3179:23: 3179 | t951 = t4*t320 | ^ Warning: ‘t4’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: 3202 | /t12*t63)) | ^ Warning: ‘t39’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2953:26: 2953 | t400 = a5*t38*t54 | ^ Warning: ‘t38’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: 3202 | /t12*t63)) | ^ Warning: ‘t36’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: Warning: ‘t35’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3174:24: 3174 | t939 = t34*t340 | ^ Warning: ‘t34’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3567:93: 3567 | t3*t19 + 12._dp*g3*t1*t24*t32) | ^ Warning: ‘t32’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3188:28: 3188 | t976 = t27*t353*t31 | ^ Warning: ‘t31’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3411:85: 3411 | t727 - t80*(t1392 + t1517 + t1577 + t1742)*Clda)*sx | ^ Warning: ‘t299’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) | ^ Warning: ‘t296’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 | ^ Warning: ‘t295’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) | ^ Warning: ‘t293’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3081:25: 3081 | t681 = t292*t293 | ^ Warning: ‘t292’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3348:34: 3348 | (4._dp*t510*t552) | ^ Warning: ‘t29’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: 3409 | *t234*t1737*t452) | ^ Warning: ‘t284’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3348:34: 3348 | (4._dp*t510*t552) | ^ Warning: ‘t282’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3302:32: 3302 | t1385 = t1382*t1383*t28 | ^ Warning: ‘t28’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) | ^ Warning: ‘t279’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3256:29: 3256 | t1243 = t278*t56*t58 | ^ Warning: ‘t278’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) | ^ Warning: ‘t274’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3086:25: 3086 | t695 = t273*t274 | ^ Warning: ‘t273’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3188:28: 3188 | t976 = t27*t353*t31 | ^ Warning: ‘t27’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3373:38: 3373 | t1630 = f2732/t258/t1626/t213 | ^ Warning: ‘t258’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3388:25: 3388 | t1699 = f94/t257 | ^ Warning: ‘t257’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3155:58: 3155 | *t862/0.2e1_dp) + t270*t830)*alpha7 | ^ Warning: ‘t256’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3368:41: 3368 | t1613 = 0.1e1_dp/t253/t1178/t523 | ^ Warning: ‘t253’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3012:34: 3012 | t522 = 0.1e1_dp/t253/t252 | ^ Warning: ‘t252’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3191:64: 3191 | 0.32e2_dp/0.3e1_dp*t325*t972 + (20._dp*t25*t976) | ^ Warning: ‘t25’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: 3559 | *t1139 - t243*t2336)*alpha6*t247*t249 | ^ Warning: ‘t249’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3348:34: 3348 | (4._dp*t510*t552) | ^ Warning: ‘t248’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: 3559 | *t1139 - t243*t2336)*alpha6*t247*t249 | ^ Warning: ‘t247’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: Warning: ‘t239’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) | ^ Warning: ‘t238’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3350:25: 3350 | t1538 = t75*t236 | ^ Warning: ‘t236’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: 3559 | *t1139 - t243*t2336)*alpha6*t247*t249 | ^ Warning: ‘t234’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3063:25: 3063 | t633 = t233*t154 | ^ Warning: ‘t233’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3245:41: 3245 | t1181 = 0.1e1_dp/t221/t1178/t185 | ^ Warning: ‘t221’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3467:44: 3467 | t1785 + t243*t1788/0.2e1_dp | ^ Warning: ‘t220’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3191:64: 3191 | 0.32e2_dp/0.3e1_dp*t325*t972 + (20._dp*t25*t976) | ^ Warning: ‘t22’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3384:27: 3384 | t1667 = t1666*t219 | ^ Warning: ‘t219’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3242:40: 3242 | t1167 = 0.1e1_dp/t215/t256/t213 | ^ Warning: ‘t215’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3381:69: 3381 | - 0.3e1_dp/0.4e1_dp*t243*t1159 + t243*t1162/0.2e1_dp | ^ Warning: ‘t214’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 | ^ Warning: ‘t213’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: 3559 | *t1139 - t243*t2336)*alpha6*t247*t249 | ^ Warning: ‘t210’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3229:47: 3229 | + 30._dp*a5*t21*t54*t65) | ^ Warning: ‘t21’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2998:25: 2998 | t489 = t209*t153 | ^ Warning: ‘t209’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) | ^ Warning: ‘t204’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: Warning: ‘t202’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: 3364 | *t58 | ^ Warning: ‘t200’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3238:35: 3238 | t1157 = 0.1e1_dp/t190/t213 | ^ Warning: ‘t190’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3114:47: 3114 | t755 = 2._dp*t748*t19 + 4._dp*t752*t32 | ^ Warning: ‘t19’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3383:35: 3383 | t1666 = 0.1e1_dp/t187/t523 | ^ Warning: ‘t187’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) | ^ Warning: ‘t186’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3092:25: 3092 | t710 = t709*t185 | ^ Warning: ‘t185’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3090:24: 3090 | t705 = t182*t72 | ^ Warning: ‘t182’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3212:25: 3212 | t1067 = t374*t18 | ^ Warning: ‘t18’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) | ^ Warning: ‘t177’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3089:26: 3089 | t702 = t176*omega | ^ Warning: ‘t176’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3191:64: 3191 | 0.32e2_dp/0.3e1_dp*t325*t972 + (20._dp*t25*t976) | ^ Warning: ‘t17’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3000:30: 3000 | t496 = t166/t167/t160 | ^ Warning: ‘t167’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) | ^ Warning: ‘t161’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: Warning: ‘t160’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3191:64: 3191 | 0.32e2_dp/0.3e1_dp*t325*t972 + (20._dp*t25*t976) | ^ Warning: ‘t16’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) | ^ Warning: ‘t156’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: 3409 | *t234*t1737*t452) | ^ Warning: ‘t155’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3453:132: 3453 | *t407) | ^ Warning: ‘t154’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: 3533 | - (5._dp*t1726*t506*t6*t407) | ^ Warning: ‘t153’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) | ^ Warning: ‘t151’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: 3254 | /0.3e1_dp*t428*t972 + (20._dp*t100*t976)) | ^ Warning: ‘t15’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: 3364 | *t58 | ^ Warning: ‘t146’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) | ^ Warning: ‘t145’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3332:26: 3332 | t1473 = t125*t141 | ^ Warning: ‘t141’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: 3459 | - (16._dp*t752*t331)) | ^ Warning: ‘t14’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3508:26: 3508 | t2195 = t136*t137 | ^ Warning: ‘t137’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) | ^ Warning: ‘t134’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 | ^ Warning: ‘t133’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3232:46: 3232 | *t303*t1119 - t338*t303*t1136 | ^ Warning: ‘t13’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3595:43: 3595 | /0.4e1_dp*t603*t1469*t2473 | ^ Warning: ‘t129’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3282:40: 3282 | t1341 = 0.1e1_dp/t128/t115/t114 | ^ Warning: ‘t128’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) | ^ Warning: ‘t127’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3479:26: 3479 | t2069 = t125*t126 | ^ Warning: ‘t126’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3506:55: 3506 | *t585 - 0.27e2_dp/0.4e1_dp*t2069*t2155 | ^ Warning: ‘t122’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3328:35: 3328 | t1442 = 0.1e1_dp/t121/t114 | ^ Warning: ‘t121’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2900:23: 2900 | t309 = t12*rho | ^ Warning: ‘t12’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3589:104: 3589 | *t81*t1430*t2279) - (t81*t93*t595*t2279) | ^ Warning: ‘t118’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3265:41: 3265 | t1273 = 0.1e1_dp/t117/t1270/t114 | ^ Warning: ‘t117’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2975:34: 2975 | t447 = 0.1e1_dp/t117/t116 | ^ Warning: ‘t116’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3499:33: 3499 | t2155 = t1341*t115*t2071 | ^ Warning: ‘t115’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3485:32: 3485 | t2090 = t480*t114*t2071 | ^ Warning: ‘t114’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3481:32: 3481 | t2072 = t480*t113*t2071 | ^ Warning: ‘t113’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) | ^ Warning: ‘t112’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3483:26: 3483 | t2084 = t110*t111 | ^ Warning: ‘t111’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: 3254 | /0.3e1_dp*t428*t972 + (20._dp*t100*t976)) | ^ Warning: ‘t11’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3583:92: 3583 | t2511) + 0.3e1_dp/0.2e1_dp*(t474)*(t481)*(t2515) | ^ Warning: ‘t108’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) | ^ Warning: ‘t106’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3259:31: 3259 | t1261 = t136*t105*t108 | ^ Warning: ‘t105’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3567:93: 3567 | t3*t19 + 12._dp*g3*t1*t24*t32) | ^ Warning: ‘t103’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: 3254 | /0.3e1_dp*t428*t972 + (20._dp*t100*t976)) | ^ Warning: ‘t102’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: Warning: ‘t100’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2940:24: 2940 | t375 = t374*t10 | ^ Warning: ‘t10’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2943:24: 2943 | t382 = t1*ndrho | ^ Warning: ‘t1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: 2494 | *(t444) | ^ Warning: ‘t988’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: 2479 | *t620*(t1240) | ^ Warning: ‘t982’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) | ^ Warning: ‘t972’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: Warning: ‘t971’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: Warning: ‘t965’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) | ^ Warning: ‘t962’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: 2514 | *t156*t444 | ^ Warning: ‘t958’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: 2597 | t2975) + 0.3e1_dp/0.2e1_dp*(t746)*(t753)*(t2979) | ^ Warning: ‘t954’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: Warning: ‘t951’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: Warning: ‘t945’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: Warning: ‘t942’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 | ^ Warning: ‘t937’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2587:63: 2587 | t159 + (2._dp*t2267*t916) + (5._dp*t2267*t919) | ^ Warning: ‘t933’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2423:27: 2423 | t2297 = t1305*t932 | ^ Warning: ‘t932’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2587:63: 2587 | t159 + (2._dp*t2267*t916) + (5._dp*t2267*t919) | ^ Warning: ‘t930’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2587:63: Warning: ‘t919’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2408:27: 2408 | t2258 = t1547*t918 | ^ Warning: ‘t918’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2587:63: 2587 | t159 + (2._dp*t2267*t916) + (5._dp*t2267*t919) | ^ Warning: ‘t916’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) | ^ Warning: ‘t910’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2482:26: 2482 | t2543 = t908*t620 | ^ Warning: ‘t908’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2436:26: 2436 | t2348 = t176*t907 | ^ Warning: ‘t907’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) | ^ Warning: ‘t904’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2404:26: 2404 | t2245 = t902*t142 | ^ Warning: ‘t902’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) | ^ Warning: ‘t898’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: Warning: ‘t897’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: Warning: ‘t893’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: 2403 | - t553*t77*t1236)/0.2e1_dp) | ^ Warning: ‘t892’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: Warning: ‘t891’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) | ^ Warning: ‘t889’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2388:47: 2388 | + t1456*t340*t1457*t440) | ^ Warning: ‘t888’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: 2403 | - t553*t77*t1236)/0.2e1_dp) | ^ Warning: ‘t885’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: Warning: ‘t880’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: 2385 | *t871*t522) + (2._dp*t508*t357*t873) - (4._dp*t877*t522) | ^ Warning: ‘t877’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) | ^ Warning: ‘t876’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: Warning: ‘t874’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: 2385 | *t871*t522) + (2._dp*t508*t357*t873) - (4._dp*t877*t522) | ^ Warning: ‘t873’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: Warning: ‘t871’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2377:26: 2377 | t2142 = t870*t507 | ^ Warning: ‘t870’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) | ^ Warning: ‘t867’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: Warning: ‘t865’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) | ^ Warning: ‘t851’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: Warning: ‘t849’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) | ^ Warning: ‘t848’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2518:114: 2518 | *t68 - 2._dp*t842*t441 + 2._dp*t85*t1265 - t85*t1282) | ^ Warning: ‘t846’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2375:93: 2375 | t441 - t842*t402 + 2._dp*t85*t1220 - t85*t1237) | ^ Warning: ‘t845’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2375:93: Warning: ‘t842’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2368:68: 2368 | t836 - t80*(t1663 + t1802 + t1898 + t2028)*Clda | ^ Warning: ‘t836’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: 2304 | *t1649)*alpha6*t284*t286) | ^ Warning: ‘t832’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: Warning: ‘t826’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: Warning: ‘t823’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: Warning: ‘t820’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: 2494 | *(t444) | ^ Warning: ‘t817’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 | ^ Warning: ‘t816’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: 2304 | *t1649)*alpha6*t284*t286) | ^ Warning: ‘t815’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: 2494 | *(t444) | ^ Warning: ‘t812’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 | ^ Warning: ‘t810’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: Warning: ‘t808’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2434:37: 2434 | *t84*t1579*t587*t444 | ^ Warning: ‘t804’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2226:93: 2226 | *t784) - (2._dp*t779*t656*t1297) | ^ Warning: ‘t803’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2434:37: 2434 | *t84*t1579*t587*t444 | ^ Warning: ‘t801’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2226:93: 2226 | *t784) - (2._dp*t779*t656*t1297) | ^ Warning: ‘t800’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2226:93: Warning: ‘t799’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2246:69: 2246 | /0.2e1_dp - t166*t1355*t83*t170 + (2._dp*t1294*t801) | ^ Warning: ‘t792’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2434:37: 2434 | *t84*t1579*t587*t444 | ^ Warning: ‘t791’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2246:69: 2246 | /0.2e1_dp - t166*t1355*t83*t170 + (2._dp*t1294*t801) | ^ Warning: ‘t787’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2434:37: 2434 | *t84*t1579*t587*t444 | ^ Warning: ‘t784’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2246:69: 2246 | /0.2e1_dp - t166*t1355*t83*t170 + (2._dp*t1294*t801) | ^ Warning: ‘t783’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2418:75: 2418 | t2269*t2271) | ^ Warning: ‘t781’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2246:69: 2246 | /0.2e1_dp - t166*t1355*t83*t170 + (2._dp*t1294*t801) | ^ Warning: ‘t780’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2581:32: 2581 | *(t783)*(t2927) | ^ Warning: ‘t779’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: 2494 | *(t444) | ^ Warning: ‘t772’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2312:26: 2312 | t1853 = t771*t275 | ^ Warning: ‘t771’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) | ^ Warning: ‘t769’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 | ^ Warning: ‘t765’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2332:58: 2332 | *(t1176)) - t267*t1731)*alpha5*t271 | ^ Warning: ‘t763’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: 2304 | *t1649)*alpha6*t284*t286) | ^ Warning: ‘t761’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: Warning: ‘t759’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2351:39: 2351 | *(t746)*(t753)*(t1318) | ^ Warning: ‘t755’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2164:27: 2164 | t1306 = t1305*t754 | ^ Warning: ‘t754’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2581:32: 2581 | *(t783)*(t2927) | ^ Warning: ‘t753’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: 2597 | t2975) + 0.3e1_dp/0.2e1_dp*(t746)*(t753)*(t2979) | ^ Warning: ‘t752’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2450:65: 2450 | *t2271 + 0.3e1_dp/0.2e1_dp*(t746)*(t753)*(t2311) | ^ Warning: ‘t748’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2351:39: 2351 | *(t746)*(t753)*(t1318) | ^ Warning: ‘t747’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2351:39: Warning: ‘t746’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2351:39: Warning: ‘t740’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2581:32: 2581 | *(t783)*(t2927) | ^ Warning: ‘t739’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2443:70: 2443 | t2363*t2305 + 0.5e1_dp/0.2e1_dp*(t735)*(t739)*(t2059) | ^ Warning: ‘t736’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2351:39: 2351 | *(t746)*(t753)*(t1318) | ^ Warning: ‘t735’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2332:58: 2332 | *(t1176)) - t267*t1731)*alpha5*t271 | ^ Warning: ‘t728’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2481:26: 2481 | t2529 = t721*t444 | ^ Warning: ‘t721’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2265:101: 2265 | *t1301) - (15._dp*t1658*t271*t588*t453) | ^ Warning: ‘t718’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2265:101: Warning: ‘t717’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2265:101: Warning: ‘t713’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2332:58: 2332 | *(t1176)) - t267*t1731)*alpha5*t271 | ^ Warning: ‘t711’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2284:69: 2284 | - 0.3e1_dp/0.4e1_dp*t280*t1723 + t280*t1726/0.2e1_dp | ^ Warning: ‘t701’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2458:26: 2458 | t2437 = t698*t444 | ^ Warning: ‘t698’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2284:69: 2284 | - 0.3e1_dp/0.4e1_dp*t280*t1723 + t280*t1726/0.2e1_dp | ^ Warning: ‘t697’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2284:69: Warning: ‘t691’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2352:35: 2352 | t1983 = 0.1e1_dp/t224/t690 | ^ Warning: ‘t690’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2270:26: 2270 | t1686 = t689*t257 | ^ Warning: ‘t689’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 | ^ Warning: ‘t685’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: 2494 | *(t444) | ^ Warning: ‘t681’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 | ^ Warning: ‘t679’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: Warning: ‘t673’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2265:101: 2265 | *t1301) - (15._dp*t1658*t271*t588*t453) | ^ Warning: ‘t669’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: 2494 | *(t444) | ^ Warning: ‘t663’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: 2514 | *t156*t444 | ^ Warning: ‘t659’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 | ^ Warning: ‘t658’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: 2304 | *t1649)*alpha6*t284*t286) | ^ Warning: ‘t657’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: 2514 | *t156*t444 | ^ Warning: ‘t656’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 | ^ Warning: ‘t653’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: 2514 | *t156*t444 | ^ Warning: ‘t645’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2318:26: 2318 | t1885 = t644*t223 | ^ Warning: ‘t644’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) | ^ Warning: ‘t639’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2468:44: 2468 | t2449 + t280*t2452/0.2e1_dp | ^ Warning: ‘t638’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: 2479 | *t620*(t1240) | ^ Warning: ‘t631’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2332:58: 2332 | *(t1176)) - t267*t1731)*alpha5*t271 | ^ Warning: ‘t629’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: 2479 | *t620*(t1240) | ^ Warning: ‘t626’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2265:101: 2265 | *t1301) - (15._dp*t1658*t271*t588*t453) | ^ Warning: ‘t624’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 | ^ Warning: ‘t621’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2482:26: 2482 | t2543 = t908*t620 | ^ Warning: ‘t620’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: 2514 | *t156*t444 | ^ Warning: ‘t617’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2265:101: 2265 | *t1301) - (15._dp*t1658*t271*t588*t453) | ^ Warning: ‘t613’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) | ^ Warning: ‘t603’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2539:27: 2539 | t2841 = t602*t1285 | ^ Warning: ‘t602’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 | ^ Warning: ‘t597’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2354:26: 2354 | t1988 = t596*t199 | ^ Warning: ‘t596’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 | ^ Warning: ‘t592’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 | ^ Warning: ‘t589’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: 2479 | *t620*(t1240) | ^ Warning: ‘t588’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: 2494 | *(t444) | ^ Warning: ‘t587’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: 2479 | *t620*(t1240) | ^ Warning: ‘t583’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: 2597 | t2975) + 0.3e1_dp/0.2e1_dp*(t746)*(t753)*(t2979) | ^ Warning: ‘t582’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2424:32: 2424 | t2305 = t581*t168*t2072 | ^ Warning: ‘t581’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: 2514 | *t156*t444 | ^ Warning: ‘t578’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: Warning: ‘t576’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2335:26: 2335 | t1923 = t176*t575 | ^ Warning: ‘t575’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2407:50: 2407 | 0.7e1_dp/0.2e1_dp*t569*t571*t1240 | ^ Warning: ‘t572’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2407:50: Warning: ‘t571’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2407:50: Warning: ‘t569’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2201:26: 2201 | t1520 = t567*t142 | ^ Warning: ‘t567’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: 2403 | - t553*t77*t1236)/0.2e1_dp) | ^ Warning: ‘t563’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: Warning: ‘t562’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: Warning: ‘t558’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) | ^ Warning: ‘t557’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: 2403 | - t553*t77*t1236)/0.2e1_dp) | ^ Warning: ‘t556’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: Warning: ‘t554’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: 2142 | *t1220 - t375*t340*t1237 | ^ Warning: ‘t553’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) | ^ Warning: ‘t552’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: ‘t551’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: ‘t550’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: ‘t542’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: ‘t540’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: ‘t539’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2195:31: 2195 | t1478 = t125*t538*t129 | ^ Warning: ‘t538’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) | ^ Warning: ‘t537’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2388:47: 2388 | + t1456*t340*t1457*t440) | ^ Warning: ‘t535’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) | ^ Warning: ‘t534’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: ‘t533’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: ‘t531’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2190:30: 2190 | t1442 = t96*t115*t525 | ^ Warning: ‘t525’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: 2385 | *t871*t522) + (2._dp*t508*t357*t873) - (4._dp*t877*t522) | ^ Warning: ‘t522’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: Warning: ‘t518’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2091:24: 2091 | t1086 = t4*t515 | ^ Warning: ‘t515’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2188:68: 2188 | *t514*t1078*t14*t517 + 0.6e1_dp*t118*t119*t1091*t77 | ^ Warning: ‘t514’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: 2385 | *t871*t522) + (2._dp*t508*t357*t873) - (4._dp*t877*t522) | ^ Warning: ‘t513’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: Warning: ‘t511’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2188:68: 2188 | *t514*t1078*t14*t517 + 0.6e1_dp*t118*t119*t1091*t77 | ^ Warning: ‘t510’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) | ^ Warning: ‘t509’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2188:68: 2188 | *t514*t1078*t14*t517 + 0.6e1_dp*t118*t119*t1091*t77 | ^ Warning: ‘t508’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2377:26: 2377 | t2142 = t870*t507 | ^ Warning: ‘t507’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2188:68: 2188 | *t514*t1078*t14*t517 + 0.6e1_dp*t118*t119*t1091*t77 | ^ Warning: ‘t504’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: 2385 | *t871*t522) + (2._dp*t508*t357*t873) - (4._dp*t877*t522) | ^ Warning: ‘t503’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: 2403 | - t553*t77*t1236)/0.2e1_dp) | ^ Warning: ‘t499’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) | ^ Warning: ‘t498’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2177:25: 2177 | t1379 = t495*t82 | ^ Warning: ‘t495’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: 2403 | - t553*t77*t1236)/0.2e1_dp) | ^ Warning: ‘t493’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: Warning: ‘t486’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: Warning: ‘t481’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2375:93: 2375 | t441 - t842*t402 + 2._dp*t85*t1220 - t85*t1237) | ^ Warning: ‘t479’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2176:132: 2176 | (F2*t1126*t68 - 2._dp*t475*t402 + 2._dp*t85*t1136 - t85*t1169)) | ^ Warning: ‘t478’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2375:93: 2375 | t441 - t842*t402 + 2._dp*t85*t1220 - t85*t1237) | ^ Warning: ‘t475’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2375:93: Warning: ‘t472’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2375:93: Warning: ‘t469’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2176:132: 2176 | (F2*t1126*t68 - 2._dp*t475*t402 + 2._dp*t85*t1136 - t85*t1169)) | ^ Warning: ‘t468’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: 2494 | *(t444) | ^ Warning: ‘t465’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: 2304 | *t1649)*alpha6*t284*t286) | ^ Warning: ‘t463’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 | ^ Warning: ‘t457’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: 2514 | *t156*t444 | ^ Warning: ‘t454’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: Warning: ‘t453’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 | ^ Warning: ‘t452’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 | ^ Warning: ‘t449’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2516:86: 2516 | + t2688)*Clda | ^ Warning: ‘t446’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2418:75: 2418 | t2269*t2271) | ^ Warning: ‘t444’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2155:34: 2155 | - t375*t340*t1282 | ^ Warning: ‘t442’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2518:114: 2518 | *t68 - 2._dp*t842*t441 + 2._dp*t85*t1265 - t85*t1282) | ^ Warning: ‘t441’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2388:47: 2388 | + t1456*t340*t1457*t440) | ^ Warning: ‘t440’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: 2135 | - (48._dp*t437*t398) | ^ Warning: ‘t437’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: Warning: ‘t433’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: Warning: ‘t432’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: Warning: ‘t429’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: Warning: ‘t428’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2155:34: 2155 | - t375*t340*t1282 | ^ Warning: ‘t426’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: 2142 | *t1220 - t375*t340*t1237 | ^ Warning: ‘t425’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2389:26: 2389 | t2224 = t424*t377 | ^ Warning: ‘t424’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2129:73: 2129 | - 0.16e2_dp/0.3e1_dp*t420*t361*t364 - (16._dp*t421*t368) | ^ Warning: ‘t421’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2129:73: Warning: ‘t420’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2151:32: 2151 | *a5*t21*t54*t65 | ^ Warning: ‘t419’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2129:73: 2129 | - 0.16e2_dp/0.3e1_dp*t420*t361*t364 - (16._dp*t421*t368) | ^ Warning: ‘t416’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2129:73: Warning: ‘t415’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: 2142 | *t1220 - t375*t340*t1237 | ^ Warning: ‘t412’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2131:25: 2131 | t1214 = t411*t18 | ^ Warning: ‘t411’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: 2514 | *t156*t444 | ^ Warning: ‘t409’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: 2494 | *(t444) | ^ Warning: ‘t406’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: 2142 | *t1220 - t375*t340*t1237 | ^ Warning: ‘t403’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2375:93: 2375 | t441 - t842*t402 + 2._dp*t85*t1220 - t85*t1237) | ^ Warning: ‘t402’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) | ^ Warning: ‘t401’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: 2135 | - (48._dp*t437*t398) | ^ Warning: ‘t398’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: Warning: ‘t392’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: 2118 | *t63) | ^ Warning: ‘t390’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: 2135 | - (48._dp*t437*t398) | ^ Warning: ‘t386’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: 2118 | *t63) | ^ Warning: ‘t385’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: Warning: ‘t384’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: 2135 | - (48._dp*t437*t398) | ^ Warning: ‘t383’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: 2118 | *t63) | ^ Warning: ‘t378’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2389:26: 2389 | t2224 = t424*t377 | ^ Warning: ‘t377’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2110:34: 2110 | t1134 = 0.1e1_dp/t376/t67 | ^ Warning: ‘t376’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2120:32: 2120 | t1171 = t375*t340*t1169 | ^ Warning: ‘t375’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: 2142 | *t1220 - t375*t340*t1237 | ^ Warning: ‘t373’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2096:36: 2096 | t1097 = 4._dp*t11*t348*t372 | ^ Warning: ‘t372’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2199:26: 2199 | t1498 = t371*t377 | ^ Warning: ‘t371’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: 2135 | - (48._dp*t437*t398) | ^ Warning: ‘t368’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: Warning: ‘t364’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2100:26: 2100 | t1115 = t363*t312 | ^ Warning: ‘t363’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2106:88: 2106 | *t25*t1123) | ^ Warning: ‘t362’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: 2135 | - (48._dp*t437*t398) | ^ Warning: ‘t361’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2129:73: 2129 | - 0.16e2_dp/0.3e1_dp*t420*t361*t364 - (16._dp*t421*t368) | ^ Warning: ‘t358’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: 2385 | *t871*t522) + (2._dp*t508*t357*t873) - (4._dp*t877*t522) | ^ Warning: ‘t357’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2129:73: 2129 | - 0.16e2_dp/0.3e1_dp*t420*t361*t364 - (16._dp*t421*t368) | ^ Warning: ‘t354’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2106:88: 2106 | *t25*t1123) | ^ Warning: ‘t353’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) | ^ Warning: ‘t352’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: 2142 | *t1220 - t375*t340*t1237 | ^ Warning: ‘t349’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) | ^ Warning: ‘t348’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: ‘t347’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: 2118 | *t63) | ^ Warning: ‘t346’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: 2142 | *t1220 - t375*t340*t1237 | ^ Warning: ‘t343’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: Warning: ‘t342’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2113:38: 2113 | t1139 = 2._dp*t375*t340*t1136 | ^ Warning: ‘t340’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: 2142 | *t1220 - t375*t340*t1237 | ^ Warning: ‘t339’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2125:26: 2125 | t1178 = t411*t338 | ^ Warning: ‘t338’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2516:86: 2516 | + t2688)*Clda | ^ Warning: ‘t1069’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: 2494 | *(t444) | ^ Warning: ‘t1066’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 | ^ Warning: ‘t1052’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: Warning: ‘t1035’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: 2494 | *(t444) | ^ Warning: ‘t1024’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: 2479 | *t620*(t1240) | ^ Warning: ‘t1009’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: Warning: ‘t1001’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2450:65: 2450 | *t2271 + 0.3e1_dp/0.2e1_dp*(t746)*(t753)*(t2311) | ^ Warning: ‘t95’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) | ^ Warning: ‘t94’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: 2597 | t2975) + 0.3e1_dp/0.2e1_dp*(t746)*(t753)*(t2979) | ^ Warning: ‘t93’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) | ^ Warning: ‘t92’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 | ^ Warning: ‘t91’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2340:30: 2340 | t1961 = t180*t90*t149 | ^ Warning: ‘t90’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 | ^ Warning: ‘t9’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2006:41: 2006 | t848 = 2._dp*t412*t88 + t11*t846 | ^ Warning: ‘t88’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2176:132: 2176 | (F2*t1126*t68 - 2._dp*t475*t402 + 2._dp*t85*t1136 - t85*t1169)) | ^ Warning: ‘t87’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2518:114: 2518 | *t68 - 2._dp*t842*t441 + 2._dp*t85*t1265 - t85*t1282) | ^ Warning: ‘t85’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2434:37: 2434 | *t84*t1579*t587*t444 | ^ Warning: ‘t84’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2587:63: 2587 | t159 + (2._dp*t2267*t916) + (5._dp*t2267*t919) | ^ Warning: ‘t83’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1836:24: 1836 | t486 = t82*t453 | ^ Warning: ‘t82’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2612:65: 2612 | e_ndrho_ndrho = e_ndrho_ndrho - t80*(t2963 + t3167)*Clda | ^ Warning: ‘t80’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: 2304 | *t1649)*alpha6*t284*t286) | ^ Warning: ‘t8’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2157:23: 2157 | t1287 = t78**2 | ^ Warning: ‘t78’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2459:30: 2459 | t2442 = t75*t409*t444 | ^ Warning: ‘t75’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2123:71: 2123 | - t1132 + t1139 - t1171 + 0.10e2_dp/0.9e1_dp*t73*t1173 | ^ Warning: ‘t73’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: 2494 | *(t444) | ^ Warning: ‘t72’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1817:53: 1817 | t444 = 2._dp*t412*t70 + t11*t426 - t375*t442 | ^ Warning: ‘t70’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2095:36: 2095 | t1094 = 6._dp*t11*t1091*t69 | ^ Warning: ‘t69’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2016:25: 2016 | t876 = t68*ndrho | ^ Warning: ‘t68’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1781:22: 1781 | t376 = t67**2 | ^ Warning: ‘t67’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2151:32: 2151 | *a5*t21*t54*t65 | ^ Warning: ‘t65’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: 2118 | *t63) | ^ Warning: ‘t63’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1790:31: 1790 | t398 = t60/t61/rho*t63 | ^ Warning: ‘t61’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: 2118 | *t63) | ^ Warning: ‘t55’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2151:32: 2151 | *a5*t21*t54*t65 | ^ Warning: ‘t49’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: 2118 | *t63) | ^ Warning: ‘t48’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2101:27: 2101 | t1119 = t46*t31*t6 | ^ Warning: ‘t46’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 | ^ Warning: ‘t44’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: 2118 | *t63) | ^ Warning: ‘t42’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2182:33: 2182 | t1409 = t116*t377*t4*t44 | ^ Warning: ‘t4’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: 2118 | *t63) | ^ Warning: ‘t39’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1813:26: 1813 | t437 = a5*t38*t54 | ^ Warning: ‘t38’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: 2118 | *t63) | ^ Warning: ‘t36’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: Warning: ‘t35’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2200:26: 2200 | t1501 = t34*t1134 | ^ Warning: ‘t34’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2368:68: 2368 | t836 - t80*(t1663 + t1802 + t1898 + t2028)*Clda | ^ Warning: ‘t336’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) | ^ Warning: ‘t333’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2332:58: 2332 | *(t1176)) - t267*t1731)*alpha5*t271 | ^ Warning: ‘t332’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: 2494 | *(t444) | ^ Warning: ‘t330’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1824:25: 1824 | t457 = t329*t330 | ^ Warning: ‘t329’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2265:101: 2265 | *t1301) - (15._dp*t1658*t271*t588*t453) | ^ Warning: ‘t321’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2151:32: 2151 | *a5*t21*t54*t65 | ^ Warning: ‘t32’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: 2304 | *t1649)*alpha6*t284*t286) | ^ Warning: ‘t319’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) | ^ Warning: ‘t316’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) | ^ Warning: ‘t315’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 | ^ Warning: ‘t311’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1963:25: 1963 | t761 = t310*t311 | ^ Warning: ‘t310’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2102:29: 2102 | t1123 = t27*t390*t31 | ^ Warning: ‘t31’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2272:38: 2272 | t1697 = f2732/t295/t1693/t250 | ^ Warning: ‘t295’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2253:25: 2253 | t1633 = f94/t294 | ^ Warning: ‘t294’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) | ^ Warning: ‘t293’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2267:41: 2267 | t1680 = 0.1e1_dp/t290/t1677/t690 | ^ Warning: ‘t290’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: 2304 | *t1649)*alpha6*t284*t286) | ^ Warning: ‘t29’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1934:34: 1934 | t689 = 0.1e1_dp/t290/t289 | ^ Warning: ‘t289’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) | ^ Warning: ‘t286’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: 2304 | *t1649)*alpha6*t284*t286) | ^ Warning: ‘t285’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) | ^ Warning: ‘t284’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2289:32: 2289 | t1770 = t1767*t1768*t28 | ^ Warning: ‘t28’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) | ^ Warning: ‘t276’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) | ^ Warning: ‘t275’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2311:25: 2311 | t1846 = t75*t273 | ^ Warning: ‘t273’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: 2514 | *t156*t444 | ^ Warning: ‘t271’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1988:25: 1988 | t815 = t270*t193 | ^ Warning: ‘t270’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: 2403 | - t553*t77*t1236)/0.2e1_dp) | ^ Warning: ‘t27’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2316:41: 2316 | t1880 = 0.1e1_dp/t258/t1677/t222 | ^ Warning: ‘t258’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2468:44: 2468 | t2449 + t280*t2452/0.2e1_dp | ^ Warning: ‘t257’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: 2514 | *t156*t444 | ^ Warning: ‘t256’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2273:40: 2273 | t1709 = 0.1e1_dp/t252/t293/t250 | ^ Warning: ‘t252’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2284:69: 2284 | - 0.3e1_dp/0.4e1_dp*t280*t1723 + t280*t1726/0.2e1_dp | ^ Warning: ‘t251’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) | ^ Warning: ‘t250’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2106:88: 2106 | *t25*t1123) | ^ Warning: ‘t25’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) | ^ Warning: ‘t247’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1909:25: 1909 | t629 = t246*t192 | ^ Warning: ‘t246’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) | ^ Warning: ‘t241’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: Warning: ‘t239’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: 2304 | *t1649)*alpha6*t284*t286) | ^ Warning: ‘t237’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2276:35: 2276 | t1722 = 0.1e1_dp/t227/t250 | ^ Warning: ‘t227’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2352:35: 2352 | t1983 = 0.1e1_dp/t224/t690 | ^ Warning: ‘t224’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: 2514 | *t156*t444 | ^ Warning: ‘t223’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1935:25: 1935 | t690 = t256*t222 | ^ Warning: ‘t222’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2106:88: 2106 | *t25*t1123) | ^ Warning: ‘t22’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1896:24: 1896 | t592 = t219*t72 | ^ Warning: ‘t219’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) | ^ Warning: ‘t214’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1907:26: 1907 | t624 = t213*omega | ^ Warning: ‘t213’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2151:32: 2151 | *a5*t21*t54*t65 | ^ Warning: ‘t21’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1930:29: 1930 | t673 = t97/t205/t199 | ^ Warning: ‘t205’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) | ^ Warning: ‘t200’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: Warning: ‘t199’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) | ^ Warning: ‘t195’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 | ^ Warning: ‘t194’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: 2494 | *(t444) | ^ Warning: ‘t193’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: 2479 | *t620*(t1240) | ^ Warning: ‘t192’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) | ^ Warning: ‘t190’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: 2385 | *t871*t522) + (2._dp*t508*t357*t873) - (4._dp*t877*t522) | ^ Warning: ‘t19’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2265:101: 2265 | *t1301) - (15._dp*t1658*t271*t588*t453) | ^ Warning: ‘t186’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) | ^ Warning: ‘t185’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2162:26: 2162 | t1304 = t166*t181 | ^ Warning: ‘t181’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) | ^ Warning: ‘t18’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2437:26: 2437 | t2363 = t176*t177 | ^ Warning: ‘t177’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 | ^ Warning: ‘t174’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: 2597 | t2975) + 0.3e1_dp/0.2e1_dp*(t746)*(t753)*(t2979) | ^ Warning: ‘t170’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2106:88: 2106 | *t25*t1123) | ^ Warning: ‘t17’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2170:40: 2170 | t1324 = 0.1e1_dp/t169/t156/t155 | ^ Warning: ‘t169’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: 2494 | *(t444) | ^ Warning: ‘t168’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2410:26: 2410 | t2269 = t166*t167 | ^ Warning: ‘t167’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2418:75: 2418 | t2269*t2271) | ^ Warning: ‘t163’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2239:35: 2239 | t1579 = 0.1e1_dp/t162/t155 | ^ Warning: ‘t162’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2106:88: 2106 | *t25*t1123) | ^ Warning: ‘t16’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: 2479 | *t620*(t1240) | ^ Warning: ‘t159’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2233:41: 2233 | t1562 = 0.1e1_dp/t158/t1559/t155 | ^ Warning: ‘t158’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1890:34: 1890 | t581 = 0.1e1_dp/t158/t157 | ^ Warning: ‘t157’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: 2514 | *t156*t444 | ^ Warning: ‘t156’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2422:32: 2422 | t2291 = t752*t155*t2072 | ^ Warning: ‘t155’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2411:32: 2411 | t2271 = t752*t154*t2072 | ^ Warning: ‘t154’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) | ^ Warning: ‘t153’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2419:26: 2419 | t2280 = t151*t152 | ^ Warning: ‘t152’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) | ^ Warning: ‘t15’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: 2597 | t2975) + 0.3e1_dp/0.2e1_dp*(t746)*(t753)*(t2979) | ^ Warning: ‘t149’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2309:32: 2309 | t1835 = t148*t149*t1562 | ^ Warning: ‘t148’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2336:31: 2336 | t1932 = t176*t147*t149 | ^ Warning: ‘t147’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) | ^ Warning: ‘t145’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1883:25: 1883 | t569 = t141*t142 | ^ Warning: ‘t141’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2375:93: 2375 | t441 - t842*t402 + 2._dp*t85*t1220 - t85*t1237) | ^ Warning: ‘t14’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) | ^ Warning: ‘t136’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: 2403 | - t553*t77*t1236)/0.2e1_dp) | ^ Warning: ‘t133’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: Warning: ‘t132’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) | ^ Warning: ‘t131’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: ‘t13’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: 2403 | - t553*t77*t1236)/0.2e1_dp) | ^ Warning: ‘t129’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) | ^ Warning: ‘t128’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) | ^ Warning: ‘t127’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1870:30: 1870 | t550 = t125*t126*t128 | ^ Warning: ‘t125’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2191:25: 2191 | t1445 = t96*t124 | ^ Warning: ‘t124’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) | ^ Warning: ‘t123’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: Warning: ‘t121’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: 2385 | *t871*t522) + (2._dp*t508*t357*t873) - (4._dp*t877*t522) | ^ Warning: ‘t120’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1760:23: 1760 | t346 = t12*rho | ^ Warning: ‘t12’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2388:47: 2388 | + t1456*t340*t1457*t440) | ^ Warning: ‘t119’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2188:68: 2188 | *t514*t1078*t14*t517 + 0.6e1_dp*t118*t119*t1091*t77 | ^ Warning: ‘t118’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) | ^ Warning: ‘t117’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: Warning: ‘t116’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: Warning: ‘t113’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1840:30: 1840 | t498 = t109/t110/t495 | ^ Warning: ‘t110’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2176:132: 2176 | (F2*t1126*t68 - 2._dp*t475*t402 + 2._dp*t85*t1136 - t85*t1169)) | ^ Warning: ‘t11’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) | ^ Warning: ‘t108’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:2106:88: 2106 | *t25*t1123) | ^ Warning: ‘t10’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F:1803:24: 1803 | t419 = t1*ndrho | ^ Warning: ‘t1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_xwpbe.mod' due to: xc_xwpbe.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xwpbe.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod mathlib.mod kinds.mod mathconstants.mod bibliography.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_cs1.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_cs1.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod base_hooks.mod xc_functionals_utilities.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_cs1.F xc_cs1.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:59:42 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_cs1.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_cs1.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_cs1.mod' due to: xc_cs1.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_cs1.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod base_hooks.mod xc_functionals_utilities.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_vwn.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod input_section_types.mod xc_rho_set_types.mod base_hooks.mod xc_functionals_utilities.mod kinds.mod bibliography.mod xc_input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F xc_vwn.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:59:44 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_vwn.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_vwn.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1476:30: 1476 | t288 = t287*t97 | ^ Warning: ‘t97’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1272:35: 1272 | t945, t948, t957, t96, t97, t972, t979, t982, t984, t986, t993, t996, x0p | ^ note: ‘t97’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1484:72: 1484 | t109*(t295*t96 + 0.3177280975e0_dp*t298*t284)*t122 | ^ Warning: ‘t96’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1272:30: 1272 | t945, t948, t957, t96, t97, t972, t979, t982, t984, t986, t993, t996, x0p | ^ note: ‘t96’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1508:56: 1508 | t55 + t93 + t127)*sc | ^ Warning: ‘t93’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1271:85: 1271 | t890, t891, t893, t896, t9, t90, t901, t903, t905, t906, t91, t914, t92, t93, t937, t942, & | ^ note: ‘t93’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1424:30: 1424 | t206 = t144*t92 | ^ Warning: ‘t92’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1271:80: 1271 | t890, t891, t893, t896, t9, t90, t901, t903, t905, t906, t91, t914, t92, t93, t937, t942, & | ^ note: ‘t92’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1765:30: 1765 | t752 = t90*t751 | ^ Warning: ‘t90’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1271:40: 1271 | t890, t891, t893, t896, t9, t90, t901, t903, t905, t906, t91, t914, t92, t93, t937, t942, & | ^ note: ‘t90’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1769:29: 1769 | t757 = t89*t91 | ^ Warning: ‘t89’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1270:92: 1270 | REAL(KIND=dp) :: t865, t866, t869, t870, t873, t874, t875, t878, t881, t884, t887, t89, & | ^ note: ‘t89’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1666:64: 1666 | *t583*t548)*t86)*t91 | ^ Warning: ‘t86’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1269:59: 1269 | t833, t834, t835, t84, t842, t851, t857, t859, t86, t862, t864 | ^ note: ‘t86’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2165:60: 2165 | *t743 - 0.160e2_dp*t764 - t492 + t365 | ^ Warning: ‘t834’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1269:19: 1269 | t833, t834, t835, t84, t842, t851, t857, t859, t86, t862, t864 | ^ note: ‘t834’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2249:111: 2249 | t2048)*t2)*sc | ^ Warning: ‘t833’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1269:13: 1269 | t833, t834, t835, t84, t842, t851, t857, t859, t86, t862, t864 | ^ note: ‘t833’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2243:80: 2243 | 0.3e1_dp*t1765 + 0.120e2_dp*t1858*t327 - 0.120e2_dp*t1776 | ^ Warning: ‘t832’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1268:97: 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & | ^ note: ‘t832’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2099:37: 2099 | + t842 - t1609 | ^ Warning: ‘t831’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1268:91: 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & | ^ note: ‘t831’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2165:60: 2165 | *t743 - 0.160e2_dp*t764 - t492 + t365 | ^ Warning: ‘t830’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1268:85: 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & | ^ note: ‘t830’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2249:111: 2249 | t2048)*t2)*sc | ^ Warning: ‘t829’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1268:79: 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & | ^ note: ‘t829’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2243:80: 2243 | 0.3e1_dp*t1765 + 0.120e2_dp*t1858*t327 - 0.120e2_dp*t1776 | ^ Warning: ‘t828’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1268:73: 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & | ^ note: ‘t828’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2099:37: 2099 | + t842 - t1609 | ^ Warning: ‘t827’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1268:67: 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & | ^ note: ‘t827’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2165:60: 2165 | *t743 - 0.160e2_dp*t764 - t492 + t365 | ^ Warning: ‘t826’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1268:61: 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & | ^ note: ‘t826’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2249:111: 2249 | t2048)*t2)*sc | ^ Warning: ‘t825’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1268:55: 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & | ^ note: ‘t825’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2249:111: 2249 | t2048)*t2)*sc | ^ Warning: ‘t824’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1268:49: 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & | ^ note: ‘t824’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2099:37: 2099 | + t842 - t1609 | ^ Warning: ‘t823’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1268:43: 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & | ^ note: ‘t823’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2215:50: 2215 | - t820 + t486 + t603 - t822 | ^ Warning: ‘t822’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1268:37: 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & | ^ note: ‘t822’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2249:111: 2249 | t2048)*t2)*sc | ^ Warning: ‘t821’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1268:31: 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & | ^ note: ‘t821’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2215:50: 2215 | - t820 + t486 + t603 - t822 | ^ Warning: ‘t820’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1268:25: 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & | ^ note: ‘t820’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2249:111: 2249 | t2048)*t2)*sc | ^ Warning: ‘t819’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1268:19: 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & | ^ note: ‘t819’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2099:37: 2099 | + t842 - t1609 | ^ Warning: ‘t818’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1268:13: 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & | ^ note: ‘t818’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2215:50: 2215 | - t820 + t486 + t603 - t822 | ^ Warning: ‘t817’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1267:94: 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & | ^ note: ‘t817’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2249:111: 2249 | t2048)*t2)*sc | ^ Warning: ‘t816’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1267:88: 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & | ^ note: ‘t816’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2249:111: 2249 | t2048)*t2)*sc | ^ Warning: ‘t815’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1267:82: 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & | ^ note: ‘t815’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2175:32: 2175 | t1832 = t814*t254 | ^ Warning: ‘t814’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1267:76: 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & | ^ note: ‘t814’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2099:37: 2099 | + t842 - t1609 | ^ Warning: ‘t813’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1267:70: 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & | ^ note: ‘t813’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2249:111: 2249 | t2048)*t2)*sc | ^ Warning: ‘t812’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1267:64: 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & | ^ note: ‘t812’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2177:32: 2177 | t1838 = t811*t202 | ^ Warning: ‘t811’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1267:58: 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & | ^ note: ‘t811’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2193:32: 2193 | t1891 = t808*t254 | ^ Warning: ‘t808’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1267:52: 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & | ^ note: ‘t808’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2181:32: 2181 | t1850 = t806*t254 | ^ Warning: ‘t806’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1267:46: 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & | ^ note: ‘t806’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2189:32: 2189 | t1870 = t804*t254 | ^ Warning: ‘t804’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1267:40: 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & | ^ note: ‘t804’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2194:32: 2194 | t1893 = t803*t305 | ^ Warning: ‘t803’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1267:34: 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & | ^ note: ‘t803’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2183:32: 2183 | t1858 = t802*t142 | ^ Warning: ‘t802’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1267:28: 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & | ^ note: ‘t802’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1448:30: 1448 | t245 = t80*t225 | ^ Warning: ‘t80’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1267:22: 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & | ^ note: ‘t80’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1924:47: 1924 | t1099 = t8**(-0.1666666667e1_dp) | ^ Warning: ‘t8’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1267:17: 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & | ^ note: ‘t8’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2225:34: 2225 | *t136*t1986 | ^ Warning: ‘t799’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1267:13: 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & | ^ note: ‘t799’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2225:34: 2225 | *t136*t1986 | ^ Warning: ‘t796’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1266:97: 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & | ^ note: ‘t796’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2243:80: 2243 | 0.3e1_dp*t1765 + 0.120e2_dp*t1858*t327 - 0.120e2_dp*t1776 | ^ Warning: ‘t793’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1266:91: 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & | ^ note: ‘t793’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2219:33: 2219 | t1975 = t1697*t789 | ^ Warning: ‘t789’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1266:85: 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & | ^ note: ‘t789’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2249:111: 2249 | t2048)*t2)*sc | ^ Warning: ‘t784’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1266:73: 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & | ^ note: ‘t784’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2176:32: 2176 | t1836 = t732*t783 | ^ Warning: ‘t783’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1266:67: 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & | ^ note: ‘t783’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2249:111: 2249 | t2048)*t2)*sc | ^ Warning: ‘t782’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1266:61: 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & | ^ note: ‘t782’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2154:38: 2154 | t1783 = 0.160e2_dp*t780 | ^ Warning: ‘t780’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1266:55: 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & | ^ note: ‘t780’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2212:29: 2212 | *t1776 | ^ Warning: ‘t779’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1266:49: 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & | ^ note: ‘t779’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2212:29: 2212 | *t1776 | ^ Warning: ‘t778’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1266:43: 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & | ^ note: ‘t778’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2212:29: 2212 | *t1776 | ^ Warning: ‘t777’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1266:37: 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & | ^ note: ‘t777’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2155:39: 2155 | t1785 = 0.2400e2_dp*t774 | ^ Warning: ‘t774’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1266:31: 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & | ^ note: ‘t774’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2202:58: 2202 | *t1897*t92 - 0.1200e2_dp*t750*t1901 | ^ Warning: ‘t773’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1266:25: 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & | ^ note: ‘t773’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2202:58: 2202 | *t1897*t92 - 0.1200e2_dp*t750*t1901 | ^ Warning: ‘t772’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1266:19: 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & | ^ note: ‘t772’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2152:64: 2152 | *t125*t340*t309 + t1775 - 0.40e1_dp*t1776 | ^ Warning: ‘t771’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1266:13: 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & | ^ note: ‘t771’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2156:37: 2156 | t1786 = 0.80e1_dp*t769 | ^ Warning: ‘t769’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1265:91: 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & | ^ note: ‘t769’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2100:37: 2100 | t1611 = 0.80e1_dp*t767 | ^ Warning: ‘t767’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1265:85: 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & | ^ note: ‘t767’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2092:36: 2092 | t1603 = 0.2e1_dp*t766 | ^ Warning: ‘t766’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1265:79: 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & | ^ note: ‘t766’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2249:111: 2249 | t2048)*t2)*sc | ^ Warning: ‘t764’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1265:73: 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & | ^ note: ‘t764’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2249:111: 2249 | t2048)*t2)*sc | ^ Warning: ‘t762’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1265:61: 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & | ^ note: ‘t762’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2096:38: 2096 | t1609 = 0.160e2_dp*t759 | ^ Warning: ‘t759’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1265:55: 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & | ^ note: ‘t759’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2202:58: 2202 | *t1897*t92 - 0.1200e2_dp*t750*t1901 | ^ Warning: ‘t758’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1265:49: 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & | ^ note: ‘t758’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2188:64: 2188 | *t133*t90*t91*t789 + 0.80e1_dp*t1671*t327 | ^ Warning: ‘t757’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1265:43: 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & | ^ note: ‘t757’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2138:52: 2138 | t1730 = 0.160e2_dp*t755*t756*t252*t91 | ^ Warning: ‘t756’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1265:37: 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & | ^ note: ‘t756’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2188:64: 2188 | *t133*t90*t91*t789 + 0.80e1_dp*t1671*t327 | ^ Warning: ‘t755’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1265:31: 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & | ^ note: ‘t755’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2091:39: 2091 | t1602 = 0.2400e2_dp*t753 | ^ Warning: ‘t753’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1265:25: 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & | ^ note: ‘t753’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2212:29: 2212 | *t1776 | ^ Warning: ‘t752’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1265:19: 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & | ^ note: ‘t752’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2146:49: 2146 | t1768 = 0.2400e2_dp*t750*t253*t751 | ^ Warning: ‘t751’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1265:13: 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & | ^ note: ‘t751’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2202:58: 2202 | *t1897*t92 - 0.1200e2_dp*t750*t1901 | ^ Warning: ‘t750’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1264:94: 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & | ^ note: ‘t750’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1444:30: 1444 | t239 = t75*t212 | ^ Warning: ‘t75’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1264:88: 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & | ^ note: ‘t75’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2095:37: 2095 | t1606 = 0.80e1_dp*t748 | ^ Warning: ‘t748’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1264:83: 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & | ^ note: ‘t748’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2093:37: 2093 | t1604 = 0.80e1_dp*t746 | ^ Warning: ‘t746’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1264:77: 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & | ^ note: ‘t746’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2094:36: 2094 | t1605 = 0.2e1_dp*t745 | ^ Warning: ‘t745’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1264:71: 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & | ^ note: ‘t745’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2143:41: 2143 | t1754 = 0.2e1_dp*t744*t254 | ^ Warning: ‘t744’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1264:65: 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & | ^ note: ‘t744’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2249:111: 2249 | t2048)*t2)*sc | ^ Warning: ‘t743’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1264:59: 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & | ^ note: ‘t743’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2153:36: 2153 | t1782 = 0.2e1_dp*t742 | ^ Warning: ‘t742’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1264:53: 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & | ^ note: ‘t742’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2144:41: 2144 | t1764 = 0.2e1_dp*t741*t202 | ^ Warning: ‘t741’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1264:47: 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & | ^ note: ‘t741’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2032:40: 2032 | t1469 = t74**(-0.40e1_dp) | ^ Warning: ‘t74’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1264:41: 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & | ^ note: ‘t74’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2207:29: 2207 | *t1094 | ^ Warning: ‘t735’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1264:36: 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & | ^ note: ‘t735’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2103:42: 2103 | t1620 = 0.80e1_dp*t733*t254 | ^ Warning: ‘t733’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1264:30: 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & | ^ note: ‘t733’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2243:80: 2243 | 0.3e1_dp*t1765 + 0.120e2_dp*t1858*t327 - 0.120e2_dp*t1776 | ^ Warning: ‘t732’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1264:24: 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & | ^ note: ‘t732’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2118:42: 2118 | t1666 = 0.80e1_dp*t730*t254 | ^ Warning: ‘t730’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1264:18: 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & | ^ note: ‘t730’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1666:64: 1666 | *t583*t548)*t86)*t91 | ^ Warning: ‘t73’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1264:12: 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & | ^ note: ‘t73’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2147:41: 2147 | t1775 = 0.2e1_dp*t729*t305 | ^ Warning: ‘t729’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1263:93: 1263 | REAL(KIND=dp) :: t704, t705, t706, t709, t712, t715, t716, t719, t722, t725, t728, t729, & | ^ note: ‘t729’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2120:32: 2120 | t1671 = t728*t142 | ^ Warning: ‘t728’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1263:87: 1263 | REAL(KIND=dp) :: t704, t705, t706, t709, t712, t715, t716, t719, t722, t725, t728, t729, & | ^ note: ‘t728’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2173:33: 2173 | *t725*t371 | ^ Warning: ‘t725’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1263:81: 1263 | REAL(KIND=dp) :: t704, t705, t706, t709, t712, t715, t716, t719, t722, t725, t728, t729, & | ^ note: ‘t725’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2173:33: 2173 | *t725*t371 | ^ Warning: ‘t722’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1263:75: 1263 | REAL(KIND=dp) :: t704, t705, t706, t709, t712, t715, t716, t719, t722, t725, t728, t729, & | ^ note: ‘t722’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2173:33: 2173 | *t725*t371 | ^ Warning: ‘t719’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1263:69: 1263 | REAL(KIND=dp) :: t704, t705, t706, t709, t712, t715, t716, t719, t722, t725, t728, t729, & | ^ note: ‘t719’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2173:33: 2173 | *t725*t371 | ^ Warning: ‘t716’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1263:63: 1263 | REAL(KIND=dp) :: t704, t705, t706, t709, t712, t715, t716, t719, t722, t725, t728, t729, & | ^ note: ‘t716’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1841:35: 1841 | t857 = 0.3e1_dp*t705 | ^ Warning: ‘t705’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1263:33: 1263 | REAL(KIND=dp) :: t704, t705, t706, t709, t712, t715, t716, t719, t722, t725, t728, t729, & | ^ note: ‘t705’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2129:32: 2129 | t1696 = t316*t704 | ^ Warning: ‘t704’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1263:27: 1263 | REAL(KIND=dp) :: t704, t705, t706, t709, t712, t715, t716, t719, t722, t725, t728, t729, & | ^ note: ‘t704’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1983:71: 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 | ^ Warning: ‘t697’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1262:66: 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 | ^ note: ‘t697’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1983:71: 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 | ^ Warning: ‘t696’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1262:60: 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 | ^ note: ‘t696’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1983:71: 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 | ^ Warning: ‘t691’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1262:54: 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 | ^ note: ‘t691’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1983:71: 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 | ^ Warning: ‘t688’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1262:48: 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 | ^ note: ‘t688’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1983:71: 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 | ^ Warning: ‘t687’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1262:42: 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 | ^ note: ‘t687’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1983:71: 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 | ^ Warning: ‘t683’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1262:36: 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 | ^ note: ‘t683’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1983:71: 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 | ^ Warning: ‘t682’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1262:30: 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 | ^ note: ‘t682’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1983:71: 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 | ^ Warning: ‘t681’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1262:24: 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 | ^ note: ‘t681’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1983:71: 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 | ^ Warning: ‘t679’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1262:13: 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 | ^ note: ‘t679’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1983:71: 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 | ^ Warning: ‘t678’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1261:96: 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & | ^ note: ‘t678’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1971:47: 1971 | *t674*t1171 - t291*t1181 | ^ Warning: ‘t674’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1261:90: 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & | ^ note: ‘t674’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1971:47: 1971 | *t674*t1171 - t291*t1181 | ^ Warning: ‘t667’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1261:84: 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & | ^ note: ‘t667’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1971:47: 1971 | *t674*t1171 - t291*t1181 | ^ Warning: ‘t666’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1261:78: 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & | ^ note: ‘t666’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1960:32: 1960 | t1238 = t874*t661 | ^ Warning: ‘t661’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1261:66: 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & | ^ note: ‘t661’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1964:43: 1964 | t1252 = t865/t659/t282*t1250 | ^ Warning: ‘t659’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1261:60: 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & | ^ note: ‘t659’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1999:61: 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 | ^ Warning: ‘t658’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1261:54: 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & | ^ note: ‘t658’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1999:61: 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 | ^ Warning: ‘t657’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1261:48: 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & | ^ note: ‘t657’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1961:30: 1961 | t1244 = t654**2 | ^ Warning: ‘t654’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1261:36: 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & | ^ note: ‘t654’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1639:39: 1639 | t542 = 0.1e1_dp/t540/t65 | ^ Warning: ‘t65’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1261:24: 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & | ^ note: ‘t65’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1999:61: 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 | ^ Warning: ‘t648’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1261:19: 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & | ^ note: ‘t648’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1999:61: 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 | ^ Warning: ‘t644’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1260:96: 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & | ^ note: ‘t644’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1999:61: 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 | ^ Warning: ‘t643’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1260:90: 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & | ^ note: ‘t643’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1999:61: 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 | ^ Warning: ‘t636’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1260:73: 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & | ^ note: ‘t636’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1999:61: 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 | ^ Warning: ‘t635’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1260:67: 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & | ^ note: ‘t635’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1999:61: 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 | ^ Warning: ‘t634’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1260:61: 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & | ^ note: ‘t634’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1999:61: 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 | ^ Warning: ‘t631’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1260:55: 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & | ^ note: ‘t631’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1999:61: 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 | ^ Warning: ‘t630’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1260:49: 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & | ^ note: ‘t630’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1999:61: 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 | ^ Warning: ‘t627’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1260:43: 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & | ^ note: ‘t627’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1953:63: 1953 | *t622*t874 - 0.9531842928e0_dp*t266*t887 | ^ Warning: ‘t622’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1260:37: 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & | ^ note: ‘t622’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1950:32: 1950 | t1168 = t619*t269 | ^ Warning: ‘t619’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1260:31: 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & | ^ note: ‘t619’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1999:61: 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 | ^ Warning: ‘t618’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1260:25: 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & | ^ note: ‘t618’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1999:61: 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 | ^ Warning: ‘t617’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1260:19: 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & | ^ note: ‘t617’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1999:61: 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 | ^ Warning: ‘t611’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1260:13: 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & | ^ note: ‘t611’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1999:61: 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 | ^ Warning: ‘t610’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1259:93: 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & | ^ note: ‘t610’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1426:30: 1426 | t208 = t149*t61 | ^ Warning: ‘t61’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1259:87: 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & | ^ note: ‘t61’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1944:32: 1944 | t1151 = t607*t874 | ^ Warning: ‘t607’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1259:76: 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & | ^ note: ‘t607’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2159:79: 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 | ^ Warning: ‘t606’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1259:70: 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & | ^ note: ‘t606’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2089:105: 2089 | t1599)*t2)*sc | ^ Warning: ‘t605’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1259:64: 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & | ^ note: ‘t605’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2137:80: 2137 | + 0.2e1_dp*t1580 - 0.40e1_dp*t1582 + 0.80e1_dp*t1671*t257 | ^ Warning: ‘t604’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1259:58: 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & | ^ note: ‘t604’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2215:50: 2215 | - t820 + t486 + t603 - t822 | ^ Warning: ‘t603’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1259:52: 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & | ^ note: ‘t603’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2159:79: 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 | ^ Warning: ‘t602’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1259:46: 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & | ^ note: ‘t602’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2102:42: 2102 | t1615 = 0.80e1_dp*t732*t601 | ^ Warning: ‘t601’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1259:40: 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & | ^ note: ‘t601’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2159:79: 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 | ^ Warning: ‘t600’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1259:34: 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & | ^ note: ‘t600’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1451:70: 1451 | t73*(t243*t60 + 0.3177280975e0_dp*t246*t232)*t86 | ^ Warning: ‘t60’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1259:28: 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & | ^ note: ‘t60’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2089:105: 2089 | t1599)*t2)*sc | ^ Warning: ‘t599’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1259:19: 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & | ^ note: ‘t599’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2137:80: 2137 | + 0.2e1_dp*t1580 - 0.40e1_dp*t1582 + 0.80e1_dp*t1671*t257 | ^ Warning: ‘t598’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1259:13: 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & | ^ note: ‘t598’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2215:50: 2215 | - t820 + t486 + t603 - t822 | ^ Warning: ‘t597’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1258:96: 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & | ^ note: ‘t597’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2159:79: 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 | ^ Warning: ‘t596’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1258:90: 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & | ^ note: ‘t596’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2159:79: 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 | ^ Warning: ‘t595’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1258:84: 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & | ^ note: ‘t595’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2089:105: 2089 | t1599)*t2)*sc | ^ Warning: ‘t594’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1258:78: 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & | ^ note: ‘t594’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2159:79: 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 | ^ Warning: ‘t593’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1258:72: 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & | ^ note: ‘t593’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1840:35: 1840 | t851 = 0.3e1_dp*t592 | ^ Warning: ‘t592’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1258:66: 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & | ^ note: ‘t592’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2148:32: 2148 | t1776 = t317*t591 | ^ Warning: ‘t591’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1258:60: 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & | ^ note: ‘t591’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2054:69: 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 | ^ Warning: ‘t583’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1258:54: 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & | ^ note: ‘t583’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2054:69: 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 | ^ Warning: ‘t582’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1258:48: 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & | ^ note: ‘t582’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2054:69: 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 | ^ Warning: ‘t577’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1258:42: 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & | ^ note: ‘t577’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2054:69: 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 | ^ Warning: ‘t574’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1258:36: 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & | ^ note: ‘t574’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2054:69: 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 | ^ Warning: ‘t573’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1258:30: 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & | ^ note: ‘t573’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1454:30: 1454 | t255 = t57*t254 | ^ Warning: ‘t57’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1258:24: 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & | ^ note: ‘t57’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2054:69: 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 | ^ Warning: ‘t569’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1258:19: 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & | ^ note: ‘t569’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2054:69: 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 | ^ Warning: ‘t568’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1258:13: 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & | ^ note: ‘t568’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2054:69: 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 | ^ Warning: ‘t567’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1257:95: 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & | ^ note: ‘t567’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2054:69: 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 | ^ Warning: ‘t565’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1257:89: 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & | ^ note: ‘t565’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2054:69: 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 | ^ Warning: ‘t564’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1257:83: 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & | ^ note: ‘t564’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2031:47: 2031 | *t560*t1394 - t239*t1404 | ^ Warning: ‘t560’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1257:77: 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & | ^ note: ‘t560’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1422:30: 1422 | t204 = t140*t56 | ^ Warning: ‘t56’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1257:71: 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & | ^ note: ‘t56’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2031:47: 2031 | *t560*t1394 - t239*t1404 | ^ Warning: ‘t553’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1257:66: 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & | ^ note: ‘t553’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2031:47: 2031 | *t560*t1394 - t239*t1404 | ^ Warning: ‘t552’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1257:60: 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & | ^ note: ‘t552’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1508:56: 1508 | t55 + t93 + t127)*sc | ^ Warning: ‘t55’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1257:54: 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & | ^ note: ‘t55’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2039:32: 2039 | t1510 = t874*t547 | ^ Warning: ‘t547’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1257:43: 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & | ^ note: ‘t547’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2043:43: 2043 | t1524 = t865/t545/t230*t1522 | ^ Warning: ‘t545’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1257:37: 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & | ^ note: ‘t545’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2070:73: 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 | ^ Warning: ‘t544’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1257:31: 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & | ^ note: ‘t544’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2070:73: 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 | ^ Warning: ‘t543’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1257:25: 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & | ^ note: ‘t543’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2040:30: 2040 | t1516 = t540**2 | ^ Warning: ‘t540’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1257:13: 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & | ^ note: ‘t540’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1386:30: 1386 | t148 = t147*t54 | ^ Warning: ‘t54’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1256:92: 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & | ^ note: ‘t54’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2070:73: 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 | ^ Warning: ‘t534’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1256:81: 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & | ^ note: ‘t534’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2070:73: 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 | ^ Warning: ‘t530’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1256:69: 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & | ^ note: ‘t530’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2070:73: 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 | ^ Warning: ‘t529’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1256:63: 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & | ^ note: ‘t529’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2070:73: 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 | ^ Warning: ‘t522’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1256:51: 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & | ^ note: ‘t522’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2070:73: 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 | ^ Warning: ‘t521’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1256:45: 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & | ^ note: ‘t521’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2070:73: 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 | ^ Warning: ‘t520’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1256:39: 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & | ^ note: ‘t520’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2070:73: 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 | ^ Warning: ‘t517’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1256:33: 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & | ^ note: ‘t517’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2070:73: 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 | ^ Warning: ‘t516’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1256:27: 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & | ^ note: ‘t516’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2070:73: 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 | ^ Warning: ‘t513’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1255:70: 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 | ^ note: ‘t513’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1601:54: 1601 | t473*t435)*t51 | ^ Warning: ‘t51’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1255:64: 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 | ^ note: ‘t51’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2024:63: 2024 | *t508*t874 - 0.9531842928e0_dp*t214*t887 | ^ Warning: ‘t508’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1255:59: 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 | ^ note: ‘t508’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2021:32: 2021 | t1391 = t505*t217 | ^ Warning: ‘t505’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1255:53: 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 | ^ note: ‘t505’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2070:73: 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 | ^ Warning: ‘t504’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1255:47: 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 | ^ note: ‘t504’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2070:73: 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 | ^ Warning: ‘t503’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1255:41: 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 | ^ note: ‘t503’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1920:47: 1920 | t1088 = t5**(-0.1666666667e1_dp) | ^ Warning: ‘t5’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1255:35: 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 | ^ note: ‘t5’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2070:73: 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 | ^ Warning: ‘t497’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1255:31: 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 | ^ note: ‘t497’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2070:73: 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 | ^ Warning: ‘t496’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1255:25: 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 | ^ note: ‘t496’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2015:32: 2015 | t1374 = t493*t874 | ^ Warning: ‘t493’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1255:13: 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 | ^ note: ‘t493’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2165:60: 2165 | *t743 - 0.160e2_dp*t764 - t492 + t365 | ^ Warning: ‘t492’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1254:96: 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & | ^ note: ‘t492’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2099:37: 2099 | + t842 - t1609 | ^ Warning: ‘t491’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1254:90: 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & | ^ note: ‘t491’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2099:37: 2099 | + t842 - t1609 | ^ Warning: ‘t490’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1254:84: 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & | ^ note: ‘t490’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2089:105: 2089 | t1599)*t2)*sc | ^ Warning: ‘t489’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1254:73: 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & | ^ note: ‘t489’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2099:37: 2099 | + t842 - t1609 | ^ Warning: ‘t488’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1254:67: 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & | ^ note: ‘t488’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2089:105: 2089 | t1599)*t2)*sc | ^ Warning: ‘t487’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1254:61: 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & | ^ note: ‘t487’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2215:50: 2215 | - t820 + t486 + t603 - t822 | ^ Warning: ‘t486’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1254:55: 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & | ^ note: ‘t486’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2159:79: 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 | ^ Warning: ‘t485’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1254:49: 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & | ^ note: ‘t485’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2159:79: 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 | ^ Warning: ‘t484’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1254:43: 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & | ^ note: ‘t484’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2089:105: 2089 | t1599)*t2)*sc | ^ Warning: ‘t483’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1254:37: 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & | ^ note: ‘t483’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2159:79: 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 | ^ Warning: ‘t482’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1254:31: 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & | ^ note: ‘t482’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2072:32: 2072 | t1576 = t481*t254 | ^ Warning: ‘t481’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1254:25: 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & | ^ note: ‘t481’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1839:35: 1839 | t842 = 0.3e1_dp*t480 | ^ Warning: ‘t480’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1254:19: 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & | ^ note: ‘t480’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2145:32: 2145 | t1765 = t320*t479 | ^ Warning: ‘t479’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1254:13: 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & | ^ note: ‘t479’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1900:44: 1900 | *t45*t1020*t984*t1027 | ^ Warning: ‘t473’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1253:96: 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & | ^ note: ‘t473’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1900:44: 1900 | *t45*t1020*t984*t1027 | ^ Warning: ‘t472’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1253:90: 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & | ^ note: ‘t472’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1900:44: 1900 | *t45*t1020*t984*t1027 | ^ Warning: ‘t467’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1253:84: 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & | ^ note: ‘t467’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1900:44: 1900 | *t45*t1020*t984*t1027 | ^ Warning: ‘t464’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1253:78: 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & | ^ note: ‘t464’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1900:44: 1900 | *t45*t1020*t984*t1027 | ^ Warning: ‘t463’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1253:72: 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & | ^ note: ‘t463’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1900:44: 1900 | *t45*t1020*t984*t1027 | ^ Warning: ‘t459’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1253:66: 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & | ^ note: ‘t459’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1900:44: 1900 | *t45*t1020*t984*t1027 | ^ Warning: ‘t458’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1253:60: 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & | ^ note: ‘t458’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1900:44: 1900 | *t45*t1020*t984*t1027 | ^ Warning: ‘t457’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1253:54: 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & | ^ note: ‘t457’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1900:44: 1900 | *t45*t1020*t984*t1027 | ^ Warning: ‘t455’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1253:48: 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & | ^ note: ‘t455’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1900:44: 1900 | *t45*t1020*t984*t1027 | ^ Warning: ‘t454’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1253:42: 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & | ^ note: ‘t454’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1876:39: 1876 | *t896 - t189*t914 | ^ Warning: ‘t450’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1253:36: 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & | ^ note: ‘t450’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1417:30: 1417 | t195 = t45*t173 | ^ Warning: ‘t45’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1253:30: 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & | ^ note: ‘t45’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2054:69: 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 | ^ Warning: ‘t447’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1253:25: 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & | ^ note: ‘t447’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2054:69: 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 | ^ Warning: ‘t444’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1253:19: 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & | ^ note: ‘t444’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1868:31: 1868 | t945 = t443*t873 | ^ Warning: ‘t443’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1253:13: 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & | ^ note: ‘t443’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1876:39: 1876 | *t896 - t189*t914 | ^ Warning: ‘t440’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1252:96: 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & | ^ note: ‘t440’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1876:39: 1876 | *t896 - t189*t914 | ^ Warning: ‘t439’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1252:90: 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & | ^ note: ‘t439’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1885:32: 1885 | t1013 = t874*t434 | ^ Warning: ‘t434’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1252:78: 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & | ^ note: ‘t434’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1889:43: 1889 | t1027 = t865/t432/t178*t1025 | ^ Warning: ‘t432’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1252:72: 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & | ^ note: ‘t432’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1917:43: 1917 | *bp*t1020*t984*t1027 | ^ Warning: ‘t431’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1252:66: 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & | ^ note: ‘t431’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1917:43: 1917 | *bp*t1020*t984*t1027 | ^ Warning: ‘t430’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1252:60: 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & | ^ note: ‘t430’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1886:30: 1886 | t1019 = t427**2 | ^ Warning: ‘t427’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1252:48: 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & | ^ note: ‘t427’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1917:43: 1917 | *bp*t1020*t984*t1027 | ^ Warning: ‘t421’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1252:36: 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & | ^ note: ‘t421’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1917:43: 1917 | *bp*t1020*t984*t1027 | ^ Warning: ‘t417’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1252:19: 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & | ^ note: ‘t417’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1917:43: 1917 | *bp*t1020*t984*t1027 | ^ Warning: ‘t416’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1252:13: 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & | ^ note: ‘t416’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1917:43: 1917 | *bp*t1020*t984*t1027 | ^ Warning: ‘t409’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1251:87: 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & | ^ note: ‘t409’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1917:43: 1917 | *bp*t1020*t984*t1027 | ^ Warning: ‘t408’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1251:81: 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & | ^ note: ‘t408’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1917:43: 1917 | *bp*t1020*t984*t1027 | ^ Warning: ‘t407’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1251:75: 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & | ^ note: ‘t407’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2070:73: 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 | ^ Warning: ‘t406’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1251:69: 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & | ^ note: ‘t406’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1917:43: 1917 | *bp*t1020*t984*t1027 | ^ Warning: ‘t403’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1251:63: 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & | ^ note: ‘t403’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1917:43: 1917 | *bp*t1020*t984*t1027 | ^ Warning: ‘t402’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1251:57: 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & | ^ note: ‘t402’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1413:30: 1413 | t189 = t40*t155 | ^ Warning: ‘t40’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1251:51: 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & | ^ note: ‘t40’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1525:35: 1525 | t355 = t4**0.20e1_dp | ^ Warning: ‘t4’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1251:46: 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & | ^ note: ‘t4’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1917:43: 1917 | *bp*t1020*t984*t1027 | ^ Warning: ‘t399’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1251:42: 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & | ^ note: ‘t399’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1865:62: 1865 | *t394*t874 - 0.9531842928e0_dp*t161*t887 | ^ Warning: ‘t394’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1251:36: 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & | ^ note: ‘t394’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2031:47: 2031 | *t560*t1394 - t239*t1404 | ^ Warning: ‘t393’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1251:30: 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & | ^ note: ‘t393’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1877:39: 1877 | t972 = t39**(-0.40e1_dp) | ^ Warning: ‘t39’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1251:12: 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & | ^ note: ‘t39’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2054:69: 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 | ^ Warning: ‘t389’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1250:95: 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & | ^ note: ‘t389’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1861:49: 1861 | t903 = 0.1211413728e1_dp*t388*t873 | ^ Warning: ‘t388’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1250:89: 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & | ^ note: ‘t388’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1858:31: 1858 | t893 = t385*t164 | ^ Warning: ‘t385’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1250:83: 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & | ^ note: ‘t385’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1917:43: 1917 | *bp*t1020*t984*t1027 | ^ Warning: ‘t384’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1250:77: 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & | ^ note: ‘t384’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1917:43: 1917 | *bp*t1020*t984*t1027 | ^ Warning: ‘t383’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1250:71: 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & | ^ note: ‘t383’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2017:32: 2017 | t1380 = t379*t217 | ^ Warning: ‘t379’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1250:60: 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & | ^ note: ‘t379’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1917:43: 1917 | *bp*t1020*t984*t1027 | ^ Warning: ‘t376’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1250:54: 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & | ^ note: ‘t376’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1917:43: 1917 | *bp*t1020*t984*t1027 | ^ Warning: ‘t375’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1250:48: 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & | ^ note: ‘t375’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2013:32: 2013 | t1371 = t372*t217 | ^ Warning: ‘t372’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1250:36: 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & | ^ note: ‘t372’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2212:29: 2212 | *t1776 | ^ Warning: ‘t371’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1250:30: 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & | ^ note: ‘t371’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1844:40: 1844 | t864 = 0.1e1_dp/t370/t130 | ^ Warning: ‘t370’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1250:24: 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & | ^ note: ‘t370’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1601:54: 1601 | t473*t435)*t51 | ^ Warning: ‘t37’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1250:18: 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & | ^ note: ‘t37’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1851:31: 1851 | t875 = t367*t874 | ^ Warning: ‘t367’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1249:87: 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & | ^ note: ‘t367’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2014:38: 2014 | t1372 = t366*t212*t1371 | ^ Warning: ‘t366’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1249:81: 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & | ^ note: ‘t366’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2165:60: 2165 | *t743 - 0.160e2_dp*t764 - t492 + t365 | ^ Warning: ‘t365’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1249:75: 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & | ^ note: ‘t365’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2099:37: 2099 | + t842 - t1609 | ^ Warning: ‘t364’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1249:69: 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & | ^ note: ‘t364’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2099:37: 2099 | + t842 - t1609 | ^ Warning: ‘t363’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1249:63: 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & | ^ note: ‘t363’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2009:32: 2009 | t1361 = t362*t202 | ^ Warning: ‘t362’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1249:57: 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & | ^ note: ‘t362’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2075:32: 2075 | t1582 = t359*t254 | ^ Warning: ‘t359’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1249:51: 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & | ^ note: ‘t359’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2073:32: 2073 | t1578 = t357*t254 | ^ Warning: ‘t357’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1249:45: 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & | ^ note: ‘t357’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2142:75: 2142 | t1626 - 0.1200e2_dp*t356*t340*t309 - 0.40e1_dp*t1668 | ^ Warning: ‘t356’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1249:39: 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & | ^ note: ‘t356’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2130:32: 2130 | t1697 = t315*t355 | ^ Warning: ‘t355’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1249:33: 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & | ^ note: ‘t355’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2010:32: 2010 | t1363 = t353*t254 | ^ Warning: ‘t353’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1249:27: 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & | ^ note: ‘t353’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2202:58: 2202 | *t1897*t92 - 0.1200e2_dp*t750*t1901 | ^ Warning: ‘t352’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1248:72: 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 | ^ note: ‘t352’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1939:32: 1939 | t1137 = t351*t305 | ^ Warning: ‘t351’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1248:66: 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 | ^ note: ‘t351’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1930:32: 1930 | t1110 = t350*t142 | ^ Warning: ‘t350’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1248:60: 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 | ^ note: ‘t350’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2111:34: 2111 | *t136*t1639 | ^ Warning: ‘t347’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1248:54: 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 | ^ note: ‘t347’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1928:28: 1928 | t1096 | ^ Warning: ‘t344’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1248:48: 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 | ^ note: ‘t344’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2225:34: 2225 | *t136*t1986 | ^ Warning: ‘t343’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1248:42: 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 | ^ note: ‘t343’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2152:64: 2152 | *t125*t340*t309 + t1775 - 0.40e1_dp*t1776 | ^ Warning: ‘t340’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1248:36: 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 | ^ note: ‘t340’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2207:29: 2207 | *t1094 | ^ Warning: ‘t338’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1248:25: 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 | ^ note: ‘t338’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2188:64: 2188 | *t133*t90*t91*t789 + 0.80e1_dp*t1671*t327 | ^ Warning: ‘t337’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1248:19: 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 | ^ note: ‘t337’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2142:75: 2142 | t1626 - 0.1200e2_dp*t356*t340*t309 - 0.40e1_dp*t1668 | ^ Warning: ‘t333’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1248:13: 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 | ^ note: ‘t333’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2225:34: 2225 | *t136*t1986 | ^ Warning: ‘t332’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1247:96: 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & | ^ note: ‘t332’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1795:90: 1795 | + t259 + t715 + t321 + t323 - t325 + t326 + t329)*sc | ^ Warning: ‘t329’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1247:90: 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & | ^ note: ‘t329’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1835:88: 1835 | + t712 + 0.2e1_dp*t326 + 0.80e1_dp*t328 + t715)*sc | ^ Warning: ‘t328’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1247:84: 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & | ^ note: ‘t328’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1821:31: 1821 | t825 = t732*t327 | ^ Warning: ‘t327’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1247:78: 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & | ^ note: ‘t327’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1835:88: 1835 | + t712 + 0.2e1_dp*t326 + 0.80e1_dp*t328 + t715)*sc | ^ Warning: ‘t326’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1247:72: 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & | ^ note: ‘t326’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1795:90: 1795 | + t259 + t715 + t321 + t323 - t325 + t326 + t329)*sc | ^ Warning: ‘t325’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1247:66: 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & | ^ note: ‘t325’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1835:88: 1835 | + t712 + 0.2e1_dp*t326 + 0.80e1_dp*t328 + t715)*sc | ^ Warning: ‘t324’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1247:60: 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & | ^ note: ‘t324’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1835:88: 1835 | + t712 + 0.2e1_dp*t326 + 0.80e1_dp*t328 + t715)*sc | ^ Warning: ‘t323’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1247:54: 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & | ^ note: ‘t323’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2101:32: 2101 | t1613 = t322*t591 | ^ Warning: ‘t322’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1247:48: 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & | ^ note: ‘t322’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1835:88: 1835 | + t712 + 0.2e1_dp*t326 + 0.80e1_dp*t328 + t715)*sc | ^ Warning: ‘t321’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1247:42: 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & | ^ note: ‘t321’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2145:32: 2145 | t1765 = t320*t479 | ^ Warning: ‘t320’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1247:36: 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & | ^ note: ‘t320’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2148:32: 2148 | t1776 = t317*t591 | ^ Warning: ‘t317’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1247:25: 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & | ^ note: ‘t317’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2129:32: 2129 | t1696 = t316*t704 | ^ Warning: ‘t316’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1247:19: 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & | ^ note: ‘t316’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2130:32: 2130 | t1697 = t315*t355 | ^ Warning: ‘t315’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1247:13: 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & | ^ note: ‘t315’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2225:34: 2225 | *t136*t1986 | ^ Warning: ‘t312’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1246:94: 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & | ^ note: ‘t312’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1751:31: 1751 | t730 = t352*t309 | ^ Warning: ‘t309’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1246:88: 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & | ^ note: ‘t309’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1739:35: 1739 | t715 = 0.2e1_dp*t306 | ^ Warning: ‘t306’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1246:82: 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & | ^ note: ‘t306’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2147:41: 2147 | t1775 = 0.2e1_dp*t729*t305 | ^ Warning: ‘t305’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1246:76: 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & | ^ note: ‘t305’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2123:54: 2123 | t1690 = 0.2400e2_dp*t771*t304*t133*t309 | ^ Warning: ‘t304’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1246:70: 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & | ^ note: ‘t304’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1491:32: 1491 | t309 = -t3 - t132 | ^ Warning: ‘t3’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1246:64: 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & | ^ note: ‘t3’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1983:71: 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 | ^ Warning: ‘t298’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1246:60: 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & | ^ note: ‘t298’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1724:31: 1724 | t691 = t297*t393 | ^ Warning: ‘t297’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1246:54: 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & | ^ note: ‘t297’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1983:71: 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 | ^ Warning: ‘t295’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1246:48: 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & | ^ note: ‘t295’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1718:31: 1718 | t679 = t678*t294 | ^ Warning: ‘t294’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1246:42: 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & | ^ note: ‘t294’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1720:31: 1720 | t682 = t293*t681 | ^ Warning: ‘t293’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1246:36: 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & | ^ note: ‘t293’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1717:43: 1717 | t674*t619 - t291*t627 | ^ Warning: ‘t291’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1246:30: 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & | ^ note: ‘t291’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1571:39: 1571 | t429 = 0.1e1_dp/t427/t29 | ^ Warning: ‘t29’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1246:24: 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & | ^ note: ‘t29’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1971:47: 1971 | *t674*t1171 - t291*t1181 | ^ Warning: ‘t288’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1246:19: 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & | ^ note: ‘t288’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1971:47: 1971 | *t674*t1171 - t291*t1181 | ^ Warning: ‘t287’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1246:13: 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & | ^ note: ‘t287’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1704:31: 1704 | t651 = t379*t283 | ^ Warning: ‘t283’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1245:89: 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & | ^ note: ‘t283’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1964:43: 1964 | t1252 = t865/t659/t282*t1250 | ^ Warning: ‘t282’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1245:83: 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & | ^ note: ‘t282’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1963:30: 1963 | t1250 = t280**2 | ^ Warning: ‘t280’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1245:77: 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & | ^ note: ‘t280’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1999:61: 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 | ^ Warning: ‘t279’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1245:66: 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & | ^ note: ‘t279’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1703:31: 1703 | t648 = t278*t393 | ^ Warning: ‘t278’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1245:60: 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & | ^ note: ‘t278’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1957:41: 1957 | t1218 = 0.1e1_dp/t654/t276 | ^ Warning: ‘t276’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1245:48: 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & | ^ note: ‘t276’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1999:61: 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 | ^ Warning: ‘t273’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1245:42: 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & | ^ note: ‘t273’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1696:31: 1696 | t634 = t272*t406 | ^ Warning: ‘t272’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1245:36: 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & | ^ note: ‘t272’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1733:62: 1733 | *t697*t662)*t122) | ^ Warning: ‘t269’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1245:25: 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & | ^ note: ‘t269’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1953:63: 1953 | *t622*t874 - 0.9531842928e0_dp*t266*t887 | ^ Warning: ‘t266’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1245:19: 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & | ^ note: ‘t266’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1999:61: 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 | ^ Warning: ‘t265’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1245:13: 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & | ^ note: ‘t265’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1943:38: 1943 | t1149 = t366*t264*t1148 | ^ Warning: ‘t264’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1244:97: 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & | ^ note: ‘t264’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1948:30: 1948 | t1165 = t263**2 | ^ Warning: ‘t263’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1244:91: 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & | ^ note: ‘t263’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1999:61: 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 | ^ Warning: ‘t260’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1244:85: 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & | ^ note: ‘t260’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1795:90: 1795 | + t259 + t715 + t321 + t323 - t325 + t326 + t329)*sc | ^ Warning: ‘t259’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1244:79: 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & | ^ note: ‘t259’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1742:88: 1742 | + t712 + 0.2e1_dp*t256 + 0.80e1_dp*t258 + t715)*sc | ^ Warning: ‘t258’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1244:73: 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & | ^ note: ‘t258’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1669:31: 1669 | t594 = t352*t257 | ^ Warning: ‘t257’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1244:67: 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & | ^ note: ‘t257’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1795:90: 1795 | + t259 + t715 + t321 + t323 - t325 + t326 + t329)*sc | ^ Warning: ‘t256’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1244:61: 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & | ^ note: ‘t256’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1738:35: 1738 | t712 = 0.2e1_dp*t255 | ^ Warning: ‘t255’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1244:55: 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & | ^ note: ‘t255’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1613:31: 1613 | t491 = t144*t254 | ^ Warning: ‘t254’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1244:49: 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & | ^ note: ‘t254’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2146:49: 2146 | t1768 = 0.2400e2_dp*t750*t253*t751 | ^ Warning: ‘t253’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1244:43: 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & | ^ note: ‘t253’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2138:52: 2138 | t1730 = 0.160e2_dp*t755*t756*t252*t91 | ^ Warning: ‘t252’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1244:37: 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & | ^ note: ‘t252’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2054:69: 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 | ^ Warning: ‘t246’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1244:31: 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & | ^ note: ‘t246’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1657:31: 1657 | t577 = t245*t393 | ^ Warning: ‘t245’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1244:25: 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & | ^ note: ‘t245’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2054:69: 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 | ^ Warning: ‘t243’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1244:19: 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & | ^ note: ‘t243’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1651:31: 1651 | t565 = t564*t242 | ^ Warning: ‘t242’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1244:13: 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & | ^ note: ‘t242’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1653:31: 1653 | t568 = t241*t567 | ^ Warning: ‘t241’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1243:95: 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & | ^ note: ‘t241’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1388:30: 1388 | t150 = t149*t24 | ^ Warning: ‘t24’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1243:89: 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & | ^ note: ‘t24’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1650:43: 1650 | t560*t505 - t239*t513 | ^ Warning: ‘t239’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1243:84: 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & | ^ note: ‘t239’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2031:47: 2031 | *t560*t1394 - t239*t1404 | ^ Warning: ‘t236’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1243:78: 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & | ^ note: ‘t236’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1637:31: 1637 | t537 = t379*t231 | ^ Warning: ‘t231’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1243:60: 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & | ^ note: ‘t231’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2043:43: 2043 | t1524 = t865/t545/t230*t1522 | ^ Warning: ‘t230’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1243:54: 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & | ^ note: ‘t230’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1420:70: 1420 | t37*(t193*t23 + 0.3177280975e0_dp*t196*t180)*t51 | ^ Warning: ‘t23’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1243:48: 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & | ^ note: ‘t23’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2042:30: 2042 | t1522 = t228**2 | ^ Warning: ‘t228’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1243:43: 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & | ^ note: ‘t228’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2070:73: 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 | ^ Warning: ‘t227’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1243:37: 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & | ^ note: ‘t227’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1636:31: 1636 | t534 = t226*t393 | ^ Warning: ‘t226’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1243:31: 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & | ^ note: ‘t226’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2036:41: 2036 | t1490 = 0.1e1_dp/t540/t224 | ^ Warning: ‘t224’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1243:19: 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & | ^ note: ‘t224’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2070:73: 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 | ^ Warning: ‘t221’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1243:13: 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & | ^ note: ‘t221’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1629:31: 1629 | t520 = t220*t406 | ^ Warning: ‘t220’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1242:94: 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & | ^ note: ‘t220’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1666:64: 1666 | *t583*t548)*t86)*t91 | ^ Warning: ‘t217’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1242:88: 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & | ^ note: ‘t217’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2024:63: 2024 | *t508*t874 - 0.9531842928e0_dp*t214*t887 | ^ Warning: ‘t214’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1242:82: 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & | ^ note: ‘t214’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2070:73: 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 | ^ Warning: ‘t213’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1242:76: 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & | ^ note: ‘t213’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2014:38: 2014 | t1372 = t366*t212*t1371 | ^ Warning: ‘t212’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1242:70: 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & | ^ note: ‘t212’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2019:30: 2019 | t1388 = t211**2 | ^ Warning: ‘t211’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1242:64: 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & | ^ note: ‘t211’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2070:73: 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 | ^ Warning: ‘t208’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1242:58: 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & | ^ note: ‘t208’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1795:90: 1795 | + t259 + t715 + t321 + t323 - t325 + t326 + t329)*sc | ^ Warning: ‘t207’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1242:52: 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & | ^ note: ‘t207’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1742:88: 1742 | + t712 + 0.2e1_dp*t256 + 0.80e1_dp*t258 + t715)*sc | ^ Warning: ‘t206’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1242:46: 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & | ^ note: ‘t206’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1795:90: 1795 | + t259 + t715 + t321 + t323 - t325 + t326 + t329)*sc | ^ Warning: ‘t205’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1242:40: 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & | ^ note: ‘t205’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2074:32: 2074 | t1580 = t204*t591 | ^ Warning: ‘t204’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1242:27: 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & | ^ note: ‘t204’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1737:35: 1737 | t709 = 0.2e1_dp*t203 | ^ Warning: ‘t203’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1241:77: 1241 | t1998, t1999, t2, t20, t2010, t2011, t2014, t2019, t202, t2025, t203 | ^ note: ‘t203’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2144:41: 2144 | t1764 = 0.2e1_dp*t741*t202 | ^ Warning: ‘t202’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1241:64: 1241 | t1998, t1999, t2, t20, t2010, t2011, t2014, t2019, t202, t2025, t203 | ^ note: ‘t202’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1508:56: 1508 | t55 + t93 + t127)*sc | ^ Warning: ‘t2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1241:25: 1241 | t1998, t1999, t2, t20, t2010, t2011, t2014, t2019, t202, t2025, t203 | ^ note: ‘t2’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1900:44: 1900 | *t45*t1020*t984*t1027 | ^ Warning: ‘t196’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1240:72: 1240 | t1901, t1904, t191, t192, t193, t1939, t1945, t1949, t195, t196, t1975, t1979, t1986, & | ^ note: ‘t196’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1592:31: 1592 | t467 = t195*t393 | ^ Warning: ‘t195’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1240:66: 1240 | t1901, t1904, t191, t192, t193, t1939, t1945, t1949, t195, t196, t1975, t1979, t1986, & | ^ note: ‘t195’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1900:44: 1900 | *t45*t1020*t984*t1027 | ^ Warning: ‘t193’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1240:39: 1240 | t1901, t1904, t191, t192, t193, t1939, t1945, t1949, t195, t196, t1975, t1979, t1986, & | ^ note: ‘t193’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1586:31: 1586 | t455 = t454*t192 | ^ Warning: ‘t192’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1240:33: 1240 | t1901, t1904, t191, t192, t193, t1939, t1945, t1949, t195, t196, t1975, t1979, t1986, & | ^ note: ‘t192’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1588:31: 1588 | t458 = t191*t457 | ^ Warning: ‘t191’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1240:27: 1240 | t1901, t1904, t191, t192, t193, t1939, t1945, t1949, t195, t196, t1975, t1979, t1986, & | ^ note: ‘t191’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1585:43: 1585 | t450*t385 - t189*t399 | ^ Warning: ‘t189’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1239:61: 1239 | t1858, t186, t1868, t1870, t1872, t1884, t1886, t189, t1891, t1893, t1894, t1897, t19, & | ^ note: ‘t189’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1733:62: 1733 | *t697*t662)*t122) | ^ Warning: ‘t186’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1239:20: 1239 | t1858, t186, t1868, t1870, t1872, t1884, t1886, t189, t1891, t1893, t1894, t1897, t19, & | ^ note: ‘t186’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1581:31: 1581 | t447 = t185*t337 | ^ Warning: ‘t185’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1238:80: 1238 | t180, t1804, t1826, t1829, t183, t1832, t1836, t1838, t1839, t184, t185, t1850, t1853, & | ^ note: ‘t185’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1876:39: 1876 | *t896 - t189*t914 | ^ Warning: ‘t184’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1238:74: 1238 | t180, t1804, t1826, t1829, t183, t1832, t1836, t1838, t1839, t184, t185, t1850, t1853, & | ^ note: ‘t184’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1392:30: 1392 | t156 = t18*t155 | ^ Warning: ‘t18’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1237:94: 1237 | t1775, t1776, t1778, t178, t1782, t1783, t1785, t1786, t1789, t179, t1795, t1797, t18, & | ^ note: ‘t18’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1569:31: 1569 | t424 = t379*t179 | ^ Warning: ‘t179’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1237:75: 1237 | t1775, t1776, t1778, t178, t1782, t1783, t1785, t1786, t1789, t179, t1795, t1797, t18, & | ^ note: ‘t179’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1889:43: 1889 | t1027 = t865/t432/t178*t1025 | ^ Warning: ‘t178’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1237:34: 1237 | t1775, t1776, t1778, t178, t1782, t1783, t1785, t1786, t1789, t179, t1795, t1797, t18, & | ^ note: ‘t178’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1888:30: 1888 | t1025 = t176**2 | ^ Warning: ‘t176’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1236:72: 1236 | t1701, t172, t1726, t173, t1730, t174, t175, t1750, t1754, t176, t1764, t1765, t1768, & | ^ note: ‘t176’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1917:43: 1917 | *bp*t1020*t984*t1027 | ^ Warning: ‘t175’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1236:52: 1236 | t1701, t172, t1726, t173, t1730, t174, t175, t1750, t1754, t176, t1764, t1765, t1768, & | ^ note: ‘t175’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1568:31: 1568 | t421 = t174*t393 | ^ Warning: ‘t174’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1236:46: 1236 | t1701, t172, t1726, t173, t1730, t174, t175, t1750, t1754, t176, t1764, t1765, t1768, & | ^ note: ‘t174’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1882:40: 1882 | t993 = 0.1e1_dp/t427/t172 | ^ Warning: ‘t172’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1236:20: 1236 | t1701, t172, t1726, t173, t1730, t174, t175, t1750, t1754, t176, t1764, t1765, t1768, & | ^ note: ‘t172’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1901:48: 1901 | t1043 = t17**(-0.2333333333e1_dp) | ^ Warning: ‘t17’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1235:94: 1235 | REAL(KIND=dp) :: t1671, t1672, t1675, t168, t169, t1690, t1694, t1696, t1697, t1698, t17, & | ^ note: ‘t17’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1917:43: 1917 | *bp*t1020*t984*t1027 | ^ Warning: ‘t169’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1235:54: 1235 | REAL(KIND=dp) :: t1671, t1672, t1675, t168, t169, t1690, t1694, t1696, t1697, t1698, t17, & | ^ note: ‘t169’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1559:31: 1559 | t403 = t402*t168 | ^ Warning: ‘t168’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1235:48: 1235 | REAL(KIND=dp) :: t1671, t1672, t1675, t168, t169, t1690, t1694, t1696, t1697, t1698, t17, & | ^ note: ‘t168’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1561:31: 1561 | t407 = t167*t406 | ^ Warning: ‘t167’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1234:75: 1234 | t1639, t164, t1653, t1654, t1657, t1659, t1664, t1666, t1668, t167 | ^ note: ‘t167’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1601:54: 1601 | t473*t435)*t51 | ^ Warning: ‘t164’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1234:20: 1234 | t1639, t164, t1653, t1654, t1657, t1659, t1664, t1666, t1668, t167 | ^ note: ‘t164’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1865:62: 1865 | *t394*t874 - 0.9531842928e0_dp*t161*t887 | ^ Warning: ‘t161’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1233:48: 1233 | t1603, t1604, t1605, t1606, t1609, t161, t1610, t1611, t1613, t1615, t1620, t1622, t1626, & | ^ note: ‘t161’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1578:31: 1578 | t440 = t439*t160 | ^ Warning: ‘t160’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1232:87: 1232 | t1570, t1576, t1578, t1580, t1582, t1588, t159, t1590, t1593, t1599, t16, t160, t1602, & | ^ note: ‘t160’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1862:49: 1862 | t905 = 0.1817120592e1_dp*t157*t371 | ^ Warning: ‘t157’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1231:93: 1231 | t1507, t151, t1510, t1516, t1517, t1522, t1524, t1527, t154, t155, t156, t1567, t157, & | ^ note: ‘t157’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1917:43: 1917 | *bp*t1020*t984*t1027 | ^ Warning: ‘t156’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1231:80: 1231 | t1507, t151, t1510, t1516, t1517, t1522, t1524, t1527, t154, t155, t156, t1567, t157, & | ^ note: ‘t156’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1848:36: 1848 | t870 = t366*t155*t869 | ^ Warning: ‘t155’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1231:74: 1231 | t1507, t151, t1510, t1516, t1517, t1522, t1524, t1527, t154, t155, t156, t1567, t157, & | ^ note: ‘t155’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1856:29: 1856 | t890 = t154**2 | ^ Warning: ‘t154’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1231:68: 1231 | t1507, t151, t1510, t1516, t1517, t1522, t1524, t1527, t154, t155, t156, t1567, t157, & | ^ note: ‘t154’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2018:32: 2018 | t1383 = t151*t513 | ^ Warning: ‘t151’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1231:20: 1231 | t1507, t151, t1510, t1516, t1517, t1522, t1524, t1527, t154, t155, t156, t1567, t157, & | ^ note: ‘t151’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1917:43: 1917 | *bp*t1020*t984*t1027 | ^ Warning: ‘t150’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1230:91: 1230 | t144, t1455, t1469, t147, t1477, t148, t1480, t1483, t149, t1490, t1493, t15, t150, & | ^ note: ‘t150’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1421:30: 1421 | t203 = t15*t202 | ^ Warning: ‘t15’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1230:85: 1230 | t144, t1455, t1469, t147, t1477, t148, t1480, t1483, t149, t1490, t1493, t15, t150, & | ^ note: ‘t15’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1917:43: 1917 | *bp*t1020*t984*t1027 | ^ Warning: ‘t149’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1230:66: 1230 | t144, t1455, t1469, t147, t1477, t148, t1480, t1483, t149, t1490, t1493, t15, t150, & | ^ note: ‘t149’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1795:90: 1795 | + t259 + t715 + t321 + t323 - t325 + t326 + t329)*sc | ^ Warning: ‘t148’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1230:46: 1230 | t144, t1455, t1469, t147, t1477, t148, t1480, t1483, t149, t1490, t1493, t15, t150, & | ^ note: ‘t148’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1919:32: 1919 | t1086 = t147*t479 | ^ Warning: ‘t147’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1230:33: 1230 | t144, t1455, t1469, t147, t1477, t148, t1480, t1483, t149, t1490, t1493, t15, t150, & | ^ note: ‘t147’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1613:31: 1613 | t491 = t144*t254 | ^ Warning: ‘t144’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1230:13: 1230 | t144, t1455, t1469, t147, t1477, t148, t1480, t1483, t149, t1490, t1493, t15, t150, & | ^ note: ‘t144’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1528:31: 1528 | t359 = t143*t340 | ^ Warning: ‘t143’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1229:94: 1229 | t1374, t1377, t1380, t1383, t1388, t1389, t1391, t1394, t140, t1404, t141, t142, t143, & | ^ note: ‘t143’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2183:32: 2183 | t1858 = t802*t142 | ^ Warning: ‘t142’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1229:88: 1229 | t1374, t1377, t1380, t1383, t1388, t1389, t1391, t1394, t140, t1404, t141, t142, t143, & | ^ note: ‘t142’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2077:32: 2077 | t1590 = t141*t704 | ^ Warning: ‘t141’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1229:82: 1229 | t1374, t1377, t1380, t1383, t1388, t1389, t1391, t1394, t140, t1404, t141, t142, t143, & | ^ note: ‘t141’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1932:32: 1932 | t1113 = t140*t355 | ^ Warning: ‘t140’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1229:69: 1229 | t1374, t1377, t1380, t1383, t1388, t1389, t1391, t1394, t140, t1404, t141, t142, t143, & | ^ note: ‘t140’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1746:31: 1746 | t722 = t343*t137 | ^ Warning: ‘t137’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1228:82: 1228 | REAL(KIND=dp) :: t1346, t1358, t136, t1360, t1361, t1363, t1365, t1368, t137, t1371, t1372, & | ^ note: ‘t137’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2173:33: 2173 | *t725*t371 | ^ Warning: ‘t136’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1228:41: 1228 | REAL(KIND=dp) :: t1346, t1358, t136, t1360, t1361, t1363, t1365, t1368, t137, t1371, t1372, & | ^ note: ‘t136’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1780:31: 1780 | t772 = t125*t133 | ^ Warning: ‘t133’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1227:56: 1227 | t1284, t129, t1299, t13, t130, t131, t132, t133, t1341, t1344 | ^ note: ‘t133’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1698:31: 1698 | t636 = t635*t131 | ^ Warning: ‘t131’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1227:44: 1227 | t1284, t129, t1299, t13, t130, t131, t132, t133, t1341, t1344 | ^ note: ‘t131’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1844:40: 1844 | t864 = 0.1e1_dp/t370/t130 | ^ Warning: ‘t130’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1227:38: 1227 | t1284, t129, t1299, t13, t130, t131, t132, t133, t1341, t1344 | ^ note: ‘t130’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1486:30: 1486 | t306 = t13*t305 | ^ Warning: ‘t13’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1227:32: 1227 | t1284, t129, t1299, t13, t130, t131, t132, t133, t1341, t1344 | ^ note: ‘t13’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:2173:33: 2173 | *t725*t371 | ^ Warning: ‘t129’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1227:20: 1227 | t1284, t129, t1299, t13, t130, t131, t132, t133, t1341, t1344 | ^ note: ‘t129’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1508:56: 1508 | t55 + t93 + t127)*sc | ^ Warning: ‘t127’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1226:94: 1226 | t1211, t1218, t122, t1221, t1235, t1238, t1244, t1245, t125, t1250, t1252, t126, t127, & | ^ note: ‘t127’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1456:31: 1456 | t257 = t126*t133 | ^ Warning: ‘t126’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1226:88: 1226 | t1211, t1218, t122, t1221, t1235, t1238, t1244, t1245, t125, t1250, t1252, t126, t127, & | ^ note: ‘t126’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1780:31: 1780 | t772 = t125*t133 | ^ Warning: ‘t125’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1226:68: 1226 | t1211, t1218, t122, t1221, t1235, t1238, t1244, t1245, t125, t1250, t1252, t126, t127, & | ^ note: ‘t125’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1733:62: 1733 | *t697*t662)*t122) | ^ Warning: ‘t122’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1226:27: 1226 | t1211, t1218, t122, t1221, t1235, t1238, t1244, t1245, t125, t1250, t1252, t126, t127, & | ^ note: ‘t122’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1381:30: 1381 | t141 = t140*t12 | ^ Warning: ‘t12’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1225:74: 1225 | t1154, t1157, t116, t1160, t1165, t1166, t1168, t1171, t1181, t12, t120, t1205, t1208, & | ^ note: ‘t12’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1481:31: 1481 | t297 = t116*t277 | ^ Warning: ‘t116’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1225:27: 1225 | t1154, t1157, t116, t1160, t1165, t1166, t1168, t1171, t1181, t12, t120, t1205, t1208, & | ^ note: ‘t116’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1477:31: 1477 | t291 = t111*t264 | ^ Warning: ‘t111’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1223:72: 1223 | t1089, t109, t1094, t1096, t1099, t11, t110, t1108, t1109, t111, t1110, t1111, t1113, & | ^ note: ‘t111’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1972:41: 1972 | t1299 = t110**(-0.40e1_dp) | ^ Warning: ‘t110’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1223:52: 1223 | t1089, t109, t1094, t1096, t1099, t11, t110, t1108, t1109, t111, t1110, t1111, t1113, & | ^ note: ‘t110’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1526:30: 1526 | t356 = t11*t355 | ^ Warning: ‘t11’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1223:46: 1223 | t1089, t109, t1094, t1096, t1099, t11, t110, t1108, t1109, t111, t1110, t1111, t1113, & | ^ note: ‘t11’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1733:62: 1733 | *t697*t662)*t122) | ^ Warning: ‘t109’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1223:20: 1223 | t1089, t109, t1094, t1096, t1099, t11, t110, t1108, t1109, t111, t1110, t1111, t1113, & | ^ note: ‘t109’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1706:40: 1706 | t656 = 0.1e1_dp/t654/t101 | ^ Warning: ‘t101’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1221:90: 1221 | REAL(KIND=dp) :: ap, bp, cp, d2f0, myrho, myrhoa, myrhob, Qa, Qf, Qp, t1, t100, t101, t1010, & | ^ note: ‘t101’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1376:29: 1376 | t132 = t1*t131 | ^ Warning: ‘t1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1221:78: 1221 | REAL(KIND=dp) :: ap, bp, cp, d2f0, myrho, myrhoa, myrhob, Qa, Qf, Qp, t1, t100, t101, t1010, & | ^ note: ‘t1’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1023:48: 1023 | t540 = 0.1817120592e1_dp*t98*t221 | ^ Warning: ‘t98’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:685:62: 685 | t92, t947, t95, t950, t953, t956, t96, t967, t97, t98, t984, t986, t990, x0p | ^ note: ‘t98’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1078:40: 1078 | *bp*t625*t565*t559 | ^ Warning: ‘t97’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:685:57: 685 | t92, t947, t95, t950, t953, t956, t96, t967, t97, t98, t984, t986, t990, x0p | ^ note: ‘t97’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:884:30: 884 | t291 = t124*t96 | ^ Warning: ‘t96’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:685:46: 685 | t92, t947, t95, t950, t953, t956, t96, t967, t97, t98, t984, t986, t990, x0p | ^ note: ‘t96’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1017:28: 1017 | t525 = t95**2 | ^ Warning: ‘t95’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:685:23: 685 | t92, t947, t95, t950, t953, t956, t96, t967, t97, t98, t984, t986, t990, x0p | ^ note: ‘t95’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:924:30: 924 | t357 = t92*t165 | ^ Warning: ‘t92’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:685:12: 685 | t92, t947, t95, t950, t953, t956, t96, t967, t97, t98, t984, t986, t990, x0p | ^ note: ‘t92’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:870:30: 870 | t261 = t260*t91 | ^ Warning: ‘t91’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:684:97: 684 | t835, t836, t838, t841, t85, t851, t853, t86, t860, t863, t872, t879, t88, t89, t90, t91, & | ^ note: ‘t91’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1005:39: 1005 | t499 = 0.1e1_dp/t220/t90 | ^ Warning: ‘t90’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:684:92: 684 | t835, t836, t838, t841, t85, t851, t853, t86, t860, t863, t872, t879, t88, t89, t90, t91, & | ^ note: ‘t90’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1078:40: 1078 | *bp*t625*t565*t559 | ^ Warning: ‘t89’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:684:87: 684 | t835, t836, t838, t841, t85, t851, t853, t86, t860, t863, t872, t879, t88, t89, t90, t91, & | ^ note: ‘t89’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:923:30: 923 | t356 = t88*t160 | ^ Warning: ‘t88’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:684:82: 684 | t835, t836, t838, t841, t85, t851, t853, t86, t860, t863, t872, t879, t88, t89, t90, t91, & | ^ note: ‘t88’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:836:75: 836 | e_b(ip) = e_b(ip) + ((t144 + t213 + t203)*t2 + t42 + t86)*sc | ^ Warning: ‘t86’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:684:53: 684 | t835, t836, t838, t841, t85, t851, t853, t86, t860, t863, t872, t879, t88, t89, t90, t91, & | ^ note: ‘t86’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:799:30: 799 | t155 = t154*t85 | ^ Warning: ‘t85’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:684:36: 684 | t835, t836, t838, t841, t85, t851, t853, t86, t860, t863, t872, t879, t88, t89, t90, t91, & | ^ note: ‘t85’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:972:67: 972 | *t443*t408)*t80) - t332 | ^ Warning: ‘t80’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:683:44: 683 | REAL(KIND=dp) :: t792, t793, t798, t80, t800, t804, t807, t808, t810, t814, t820, t823, & | ^ note: ‘t80’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:822:30: 822 | t193 = t74*t173 | ^ Warning: ‘t74’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:682:18: 682 | t732, t74, t743, t745, t748, t752, t755, t758, t769, t78 | ^ note: ‘t74’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:818:30: 818 | t187 = t69*t160 | ^ Warning: ‘t69’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:681:28: 681 | t665, t67, t68, t69, t690, t693, t696, t7, t705, t71, t710, t719, t720, t721, t727, t729, & | ^ note: ‘t69’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1090:39: 1090 | t769 = t68**(-0.40e1_dp) | ^ Warning: ‘t68’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:681:23: 681 | t665, t67, t68, t69, t690, t693, t696, t7, t705, t71, t710, t719, t720, t721, t727, t729, & | ^ note: ‘t68’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:972:67: 972 | *t443*t408)*t80) - t332 | ^ Warning: ‘t67’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:681:18: 681 | t665, t67, t68, t69, t690, t693, t696, t7, t705, t71, t710, t719, t720, t721, t727, t729, & | ^ note: ‘t67’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:945:39: 945 | t402 = 0.1e1_dp/t400/t59 | ^ Warning: ‘t59’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:680:47: 680 | t567, t570, t573, t58, t583, t589, t59, t595, t596, t6, t601, t603, t613, t62, t625, t64, & | ^ note: ‘t59’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:800:29: 800 | t156 = t88*t55 | ^ Warning: ‘t55’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:679:77: 679 | t522, t525, t526, t528, t531, t536, t538, t54, t540, t541, t549, t55, t559, t563, t565, & | ^ note: ‘t55’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:826:26: 826 | t144 | ^ Warning: ‘t54’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:679:54: 679 | t522, t525, t526, t528, t531, t536, t538, t54, t540, t541, t549, t55, t559, t563, t565, & | ^ note: ‘t54’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:827:30: 827 | t203 = t51*t202 | ^ Warning: ‘t51’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:678:70: 678 | t494, t497, t499, t5, t500, t501, t504, t505, t508, t509, t51, t510, t513, t516, t519, & | ^ note: ‘t51’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:764:27: 764 | t97 = t5*t96 | ^ Warning: ‘t5’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:678:29: 678 | t494, t497, t499, t5, t500, t501, t504, t505, t508, t509, t51, t510, t513, t516, t519, & | ^ note: ‘t5’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1165:106: 1165 | + t950)*t2 + t953 + t350 + 0.4e1_dp*t351 + t956 + t990 + t490)*sc | ^ Warning: ‘t490’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:677:95: 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & | ^ note: ‘t490’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1184:101: 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc | ^ Warning: ‘t489’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:677:84: 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & | ^ note: ‘t489’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1167:32: 1167 | t1019 = t488*t202 | ^ Warning: ‘t488’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:677:78: 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & | ^ note: ‘t488’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1184:101: 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc | ^ Warning: ‘t485’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:677:72: 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & | ^ note: ‘t485’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1184:101: 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc | ^ Warning: ‘t482’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:677:66: 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & | ^ note: ‘t482’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1083:47: 1083 | t732 = t48**(-0.1666666667e1_dp) | ^ Warning: ‘t48’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:677:60: 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & | ^ note: ‘t48’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1184:101: 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc | ^ Warning: ‘t479’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:677:55: 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & | ^ note: ‘t479’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1184:101: 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc | ^ Warning: ‘t475’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:677:49: 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & | ^ note: ‘t475’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1184:101: 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc | ^ Warning: ‘t472’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:677:43: 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & | ^ note: ‘t472’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1158:35: 1158 | t990 = 0.2e1_dp*t471 | ^ Warning: ‘t471’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:677:37: 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & | ^ note: ‘t471’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1156:40: 1156 | t984 = 0.2e1_dp*t470*t202 | ^ Warning: ‘t470’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:677:31: 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & | ^ note: ‘t470’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1176:50: 1176 | + t489)*sc | ^ Warning: ‘t467’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:677:25: 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & | ^ note: ‘t467’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1176:50: 1176 | + t489)*sc | ^ Warning: ‘t464’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:677:19: 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & | ^ note: ‘t464’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1176:50: 1176 | + t489)*sc | ^ Warning: ‘t461’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:677:13: 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & | ^ note: ‘t461’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1176:50: 1176 | + t489)*sc | ^ Warning: ‘t458’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:676:91: 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & | ^ note: ‘t458’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1147:35: 1147 | t956 = 0.3e1_dp*t452 | ^ Warning: ‘t452’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:676:73: 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & | ^ note: ‘t452’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1157:31: 1157 | t986 = t212*t451 | ^ Warning: ‘t451’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:676:67: 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & | ^ note: ‘t451’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1080:47: 1080 | t721 = t45**(-0.1666666667e1_dp) | ^ Warning: ‘t45’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:676:61: 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & | ^ note: ‘t45’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1128:51: 1128 | - 0.1588640487e1_dp*t437*t860 | ^ Warning: ‘t443’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:676:56: 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & | ^ note: ‘t443’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1128:51: 1128 | - 0.1588640487e1_dp*t437*t860 | ^ Warning: ‘t442’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:676:50: 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & | ^ note: ‘t442’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1128:51: 1128 | - 0.1588640487e1_dp*t437*t860 | ^ Warning: ‘t437’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:676:39: 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & | ^ note: ‘t437’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1128:51: 1128 | - 0.1588640487e1_dp*t437*t860 | ^ Warning: ‘t434’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:676:33: 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & | ^ note: ‘t434’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1128:51: 1128 | - 0.1588640487e1_dp*t437*t860 | ^ Warning: ‘t433’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:676:27: 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & | ^ note: ‘t433’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:794:29: 794 | t146 = t43*t91 | ^ Warning: ‘t43’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:675:71: 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 | ^ note: ‘t43’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1128:51: 1128 | - 0.1588640487e1_dp*t437*t860 | ^ Warning: ‘t429’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:675:66: 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 | ^ note: ‘t429’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1128:51: 1128 | - 0.1588640487e1_dp*t437*t860 | ^ Warning: ‘t428’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:675:60: 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 | ^ note: ‘t428’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1128:51: 1128 | - 0.1588640487e1_dp*t437*t860 | ^ Warning: ‘t427’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:675:54: 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 | ^ note: ‘t427’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1128:51: 1128 | - 0.1588640487e1_dp*t437*t860 | ^ Warning: ‘t425’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:675:48: 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 | ^ note: ‘t425’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1128:51: 1128 | - 0.1588640487e1_dp*t437*t860 | ^ Warning: ‘t424’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:675:42: 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 | ^ note: ‘t424’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1114:39: 1114 | *t841 - t187*t851 | ^ Warning: ‘t420’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:675:36: 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 | ^ note: ‘t420’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:836:75: 836 | e_b(ip) = e_b(ip) + ((t144 + t213 + t203)*t2 + t42 + t86)*sc | ^ Warning: ‘t42’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:675:30: 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 | ^ note: ‘t42’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1114:39: 1114 | *t841 - t187*t851 | ^ Warning: ‘t413’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:675:25: 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 | ^ note: ‘t413’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1114:39: 1114 | *t841 - t187*t851 | ^ Warning: ‘t412’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:675:19: 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 | ^ note: ‘t412’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1089:31: 1089 | t758 = t509*t407 | ^ Warning: ‘t407’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:674:95: 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & | ^ note: ‘t407’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1094:41: 1094 | t800 = t500/t405/t178*t798 | ^ Warning: ‘t405’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:674:89: 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & | ^ note: ‘t405’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1144:37: 1144 | *t389*t573*t748 | ^ Warning: ‘t404’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:674:83: 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & | ^ note: ‘t404’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1144:37: 1144 | *t389*t573*t748 | ^ Warning: ‘t403’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:674:77: 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & | ^ note: ‘t403’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1116:35: 1116 | t863 = 0.1e1_dp/t400 | ^ Warning: ‘t400’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:674:65: 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & | ^ note: ‘t400’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1039:46: 1039 | t613 = t4**(-0.2333333333e1_dp) | ^ Warning: ‘t4’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:674:59: 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & | ^ note: ‘t4’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1144:37: 1144 | *t389*t573*t748 | ^ Warning: ‘t394’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:674:49: 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & | ^ note: ‘t394’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1144:37: 1144 | *t389*t573*t748 | ^ Warning: ‘t390’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:674:37: 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & | ^ note: ‘t390’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1144:37: 1144 | *t389*t573*t748 | ^ Warning: ‘t389’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:674:31: 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & | ^ note: ‘t389’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1144:37: 1144 | *t389*t573*t748 | ^ Warning: ‘t382’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:674:19: 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & | ^ note: ‘t382’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1144:37: 1144 | *t389*t573*t748 | ^ Warning: ‘t381’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:674:13: 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & | ^ note: ‘t381’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1144:37: 1144 | *t389*t573*t748 | ^ Warning: ‘t380’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:673:95: 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & | ^ note: ‘t380’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:908:60: 908 | *t325*t287)*t38) | ^ Warning: ‘t38’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:673:89: 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & | ^ note: ‘t38’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1144:37: 1144 | *t389*t573*t748 | ^ Warning: ‘t377’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:673:84: 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & | ^ note: ‘t377’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1144:37: 1144 | *t389*t573*t748 | ^ Warning: ‘t376’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:673:78: 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & | ^ note: ‘t376’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1144:37: 1144 | *t389*t573*t748 | ^ Warning: ‘t373’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:673:72: 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & | ^ note: ‘t373’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1107:62: 1107 | *t368*t509 - 0.9531842928e0_dp*t162*t522 | ^ Warning: ‘t368’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:673:66: 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & | ^ note: ‘t368’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1099:30: 1099 | t814 = t92*t365 | ^ Warning: ‘t365’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:673:60: 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & | ^ note: ‘t365’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1144:37: 1144 | *t389*t573*t748 | ^ Warning: ‘t364’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:673:54: 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & | ^ note: ‘t364’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1144:37: 1144 | *t389*t573*t748 | ^ Warning: ‘t363’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:673:48: 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & | ^ note: ‘t363’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1144:37: 1144 | *t389*t573*t748 | ^ Warning: ‘t357’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:673:37: 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & | ^ note: ‘t357’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1144:37: 1144 | *t389*t573*t748 | ^ Warning: ‘t356’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:673:31: 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & | ^ note: ‘t356’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1098:31: 1098 | t810 = t353*t509 | ^ Warning: ‘t353’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:673:19: 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & | ^ note: ‘t353’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1176:50: 1176 | + t489)*sc | ^ Warning: ‘t352’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:673:13: 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & | ^ note: ‘t352’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1165:106: 1165 | + t950)*t2 + t953 + t350 + 0.4e1_dp*t351 + t956 + t990 + t490)*sc | ^ Warning: ‘t351’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:672:96: 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & | ^ note: ‘t351’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1165:106: 1165 | + t950)*t2 + t953 + t350 + 0.4e1_dp*t351 + t956 + t990 + t490)*sc | ^ Warning: ‘t350’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:672:90: 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & | ^ note: ‘t350’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1084:31: 1084 | t743 = t349*t202 | ^ Warning: ‘t349’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:672:84: 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & | ^ note: ‘t349’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1165:106: 1165 | + t950)*t2 + t953 + t350 + 0.4e1_dp*t351 + t956 + t990 + t490)*sc | ^ Warning: ‘t346’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:672:78: 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & | ^ note: ‘t346’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1153:89: 1153 | + t953 + 0.3e1_dp*t350 + 0.6e1_dp*t351 + t956)*sc | ^ Warning: ‘t343’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:672:72: 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & | ^ note: ‘t343’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1184:101: 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc | ^ Warning: ‘t342’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:672:66: 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & | ^ note: ‘t342’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1165:106: 1165 | + t950)*t2 + t953 + t350 + 0.4e1_dp*t351 + t956 + t990 + t490)*sc | ^ Warning: ‘t339’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:672:60: 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & | ^ note: ‘t339’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1165:106: 1165 | + t950)*t2 + t953 + t350 + 0.4e1_dp*t351 + t956 + t990 + t490)*sc | ^ Warning: ‘t337’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:672:54: 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & | ^ note: ‘t337’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1153:89: 1153 | + t953 + 0.3e1_dp*t350 + 0.6e1_dp*t351 + t956)*sc | ^ Warning: ‘t334’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:672:48: 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & | ^ note: ‘t334’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1184:101: 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc | ^ Warning: ‘t333’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:672:42: 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & | ^ note: ‘t333’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1146:35: 1146 | t953 = 0.3e1_dp*t332 | ^ Warning: ‘t332’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:672:36: 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & | ^ note: ‘t332’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1062:51: 1062 | t133*t10 + 0.2e1_dp*t307*t105 | ^ Warning: ‘t325’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:672:30: 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & | ^ note: ‘t325’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1062:51: 1062 | t133*t10 + 0.2e1_dp*t307*t105 | ^ Warning: ‘t324’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:672:24: 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & | ^ note: ‘t324’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:789:30: 789 | t136 = t32*t114 | ^ Warning: ‘t32’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:672:18: 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & | ^ note: ‘t32’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1062:51: 1062 | t133*t10 + 0.2e1_dp*t307*t105 | ^ Warning: ‘t319’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:672:13: 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & | ^ note: ‘t319’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1062:51: 1062 | t133*t10 + 0.2e1_dp*t307*t105 | ^ Warning: ‘t316’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:671:94: 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & | ^ note: ‘t316’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1062:51: 1062 | t133*t10 + 0.2e1_dp*t307*t105 | ^ Warning: ‘t315’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:671:88: 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & | ^ note: ‘t315’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1062:51: 1062 | t133*t10 + 0.2e1_dp*t307*t105 | ^ Warning: ‘t311’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:671:82: 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & | ^ note: ‘t311’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1062:51: 1062 | t133*t10 + 0.2e1_dp*t307*t105 | ^ Warning: ‘t310’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:671:76: 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & | ^ note: ‘t310’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1062:51: 1062 | t133*t10 + 0.2e1_dp*t307*t105 | ^ Warning: ‘t309’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:671:70: 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & | ^ note: ‘t309’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1062:51: 1062 | t133*t10 + 0.2e1_dp*t307*t105 | ^ Warning: ‘t307’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:671:64: 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & | ^ note: ‘t307’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1062:51: 1062 | t133*t10 + 0.2e1_dp*t307*t105 | ^ Warning: ‘t306’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:671:58: 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & | ^ note: ‘t306’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1051:39: 1051 | *t531 - t130*t549 | ^ Warning: ‘t302’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:671:52: 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & | ^ note: ‘t302’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:831:32: 831 | t206 = -t3 - t146 | ^ Warning: ‘t3’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:671:46: 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & | ^ note: ‘t3’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1128:51: 1128 | - 0.1588640487e1_dp*t437*t860 | ^ Warning: ‘t299’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:671:42: 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & | ^ note: ‘t299’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1128:51: 1128 | - 0.1588640487e1_dp*t437*t860 | ^ Warning: ‘t296’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:671:36: 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & | ^ note: ‘t296’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1043:31: 1043 | t693 = t295*t508 | ^ Warning: ‘t295’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:671:30: 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & | ^ note: ‘t295’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1051:39: 1051 | *t531 - t130*t549 | ^ Warning: ‘t292’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:671:24: 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & | ^ note: ‘t292’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1051:39: 1051 | *t531 - t130*t549 | ^ Warning: ‘t291’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:671:18: 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & | ^ note: ‘t291’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1034:31: 1034 | t589 = t509*t286 | ^ Warning: ‘t286’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:670:90: 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & | ^ note: ‘t286’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1038:41: 1038 | t603 = t500/t284/t119*t601 | ^ Warning: ‘t284’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:670:84: 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & | ^ note: ‘t284’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1078:40: 1078 | *bp*t625*t565*t559 | ^ Warning: ‘t283’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:670:78: 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & | ^ note: ‘t283’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1078:40: 1078 | *bp*t625*t565*t559 | ^ Warning: ‘t282’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:670:72: 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & | ^ note: ‘t282’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1035:29: 1035 | t595 = t279**2 | ^ Warning: ‘t279’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:670:60: 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & | ^ note: ‘t279’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1078:40: 1078 | *bp*t625*t565*t559 | ^ Warning: ‘t273’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:670:48: 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & | ^ note: ‘t273’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:785:29: 785 | t130 = t27*t96 | ^ Warning: ‘t27’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:670:36: 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & | ^ note: ‘t27’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1078:40: 1078 | *bp*t625*t565*t559 | ^ Warning: ‘t269’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:670:31: 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & | ^ note: ‘t269’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1078:40: 1078 | *bp*t625*t565*t559 | ^ Warning: ‘t268’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:670:25: 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & | ^ note: ‘t268’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1078:40: 1078 | *bp*t625*t565*t559 | ^ Warning: ‘t261’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:670:13: 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & | ^ note: ‘t261’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1078:40: 1078 | *bp*t625*t565*t559 | ^ Warning: ‘t260’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:669:97: 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & | ^ note: ‘t260’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1041:39: 1041 | t665 = t26**(-0.40e1_dp) | ^ Warning: ‘t26’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:669:91: 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & | ^ note: ‘t26’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1078:40: 1078 | *bp*t625*t565*t559 | ^ Warning: ‘t259’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:669:86: 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & | ^ note: ‘t259’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1144:37: 1144 | *t389*t573*t748 | ^ Warning: ‘t258’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:669:80: 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & | ^ note: ‘t258’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1078:40: 1078 | *bp*t625*t565*t559 | ^ Warning: ‘t255’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:669:74: 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & | ^ note: ‘t255’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1078:40: 1078 | *bp*t625*t565*t559 | ^ Warning: ‘t254’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:669:68: 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & | ^ note: ‘t254’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1078:40: 1078 | *bp*t625*t565*t559 | ^ Warning: ‘t251’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:669:62: 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & | ^ note: ‘t251’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1026:62: 1026 | *t246*t509 - 0.9531842928e0_dp*t102*t522 | ^ Warning: ‘t246’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:669:51: 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & | ^ note: ‘t246’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1114:39: 1114 | *t841 - t187*t851 | ^ Warning: ‘t245’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:669:45: 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & | ^ note: ‘t245’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1128:51: 1128 | - 0.1588640487e1_dp*t437*t860 | ^ Warning: ‘t241’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:669:27: 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & | ^ note: ‘t241’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1022:49: 1022 | t538 = 0.1211413728e1_dp*t240*t508 | ^ Warning: ‘t240’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:668:72: 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 | ^ note: ‘t240’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:908:60: 908 | *t325*t287)*t38) | ^ Warning: ‘t24’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:668:66: 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 | ^ note: ‘t24’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1013:30: 1013 | t513 = t92*t237 | ^ Warning: ‘t237’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:668:61: 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 | ^ note: ‘t237’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1078:40: 1078 | *bp*t625*t565*t559 | ^ Warning: ‘t236’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:668:55: 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 | ^ note: ‘t236’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1078:40: 1078 | *bp*t625*t565*t559 | ^ Warning: ‘t235’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:668:49: 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 | ^ note: ‘t235’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1100:31: 1100 | t820 = t231*t165 | ^ Warning: ‘t231’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:668:43: 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 | ^ note: ‘t231’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1176:50: 1176 | + t489)*sc | ^ Warning: ‘t230’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:668:37: 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 | ^ note: ‘t230’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1078:40: 1078 | *bp*t625*t565*t559 | ^ Warning: ‘t226’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:668:31: 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 | ^ note: ‘t226’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1078:40: 1078 | *bp*t625*t565*t559 | ^ Warning: ‘t225’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:668:25: 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 | ^ note: ‘t225’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1096:31: 1096 | t807 = t222*t165 | ^ Warning: ‘t222’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:668:13: 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 | ^ note: ‘t222’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1176:50: 1176 | + t489)*sc | ^ Warning: ‘t221’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:667:94: 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & | ^ note: ‘t221’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1005:39: 1005 | t499 = 0.1e1_dp/t220/t90 | ^ Warning: ‘t220’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:667:88: 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & | ^ note: ‘t220’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1012:31: 1012 | t510 = t217*t509 | ^ Warning: ‘t217’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:667:70: 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & | ^ note: ‘t217’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1009:35: 1009 | t505 = t216*t96*t504 | ^ Warning: ‘t216’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:667:64: 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & | ^ note: ‘t216’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:999:102: 999 | e_bb(ip) = e_bb(ip) + ((t332 + t489 + t490 + t452)*t2 + t455 + 0.2e1_dp*t213 + t457)*sc | ^ Warning: ‘t213’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:667:58: 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & | ^ note: ‘t213’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1157:31: 1157 | t986 = t212*t451 | ^ Warning: ‘t212’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:667:52: 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & | ^ note: ‘t212’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1184:101: 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc | ^ Warning: ‘t209’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:667:41: 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & | ^ note: ‘t209’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1184:101: 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc | ^ Warning: ‘t206’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:667:35: 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & | ^ note: ‘t206’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:975:35: 975 | t457 = 0.2e1_dp*t203 | ^ Warning: ‘t203’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:667:29: 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & | ^ note: ‘t203’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1156:40: 1156 | t984 = 0.2e1_dp*t470*t202 | ^ Warning: ‘t202’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:667:23: 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & | ^ note: ‘t202’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:836:75: 836 | e_b(ip) = e_b(ip) + ((t144 + t213 + t203)*t2 + t42 + t86)*sc | ^ Warning: ‘t2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:667:17: 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & | ^ note: ‘t2’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1128:51: 1128 | - 0.1588640487e1_dp*t437*t860 | ^ Warning: ‘t194’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:667:13: 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & | ^ note: ‘t194’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:963:31: 963 | t437 = t193*t245 | ^ Warning: ‘t193’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:666:96: 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & | ^ note: ‘t193’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1128:51: 1128 | - 0.1588640487e1_dp*t437*t860 | ^ Warning: ‘t191’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:666:90: 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & | ^ note: ‘t191’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:957:31: 957 | t425 = t424*t190 | ^ Warning: ‘t190’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:666:84: 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & | ^ note: ‘t190’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:959:31: 959 | t428 = t189*t427 | ^ Warning: ‘t189’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:666:73: 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & | ^ note: ‘t189’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:956:43: 956 | t420*t365 - t187*t373 | ^ Warning: ‘t187’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:666:67: 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & | ^ note: ‘t187’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1114:39: 1114 | *t841 - t187*t851 | ^ Warning: ‘t184’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:666:61: 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & | ^ note: ‘t184’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:943:31: 943 | t397 = t231*t179 | ^ Warning: ‘t179’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:666:43: 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & | ^ note: ‘t179’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1094:41: 1094 | t800 = t500/t405/t178*t798 | ^ Warning: ‘t178’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:666:37: 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & | ^ note: ‘t178’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1093:29: 1093 | t798 = t176**2 | ^ Warning: ‘t176’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:666:31: 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & | ^ note: ‘t176’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1144:37: 1144 | *t389*t573*t748 | ^ Warning: ‘t175’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:666:25: 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & | ^ note: ‘t175’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:942:31: 942 | t394 = t174*t245 | ^ Warning: ‘t174’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:666:19: 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & | ^ note: ‘t174’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1117:40: 1117 | t872 = 0.1e1_dp/t400/t172 | ^ Warning: ‘t172’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:665:95: 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & | ^ note: ‘t172’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1144:37: 1144 | *t389*t573*t748 | ^ Warning: ‘t169’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:665:89: 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & | ^ note: ‘t169’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:935:31: 935 | t380 = t168*t258 | ^ Warning: ‘t168’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:665:83: 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & | ^ note: ‘t168’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:972:67: 972 | *t443*t408)*t80) - t332 | ^ Warning: ‘t165’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:665:77: 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & | ^ note: ‘t165’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1107:62: 1107 | *t368*t509 - 0.9531842928e0_dp*t162*t522 | ^ Warning: ‘t162’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:665:71: 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & | ^ note: ‘t162’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1144:37: 1144 | *t389*t573*t748 | ^ Warning: ‘t161’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:665:65: 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & | ^ note: ‘t161’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:923:30: 923 | t356 = t88*t160 | ^ Warning: ‘t160’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:665:59: 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & | ^ note: ‘t160’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:878:39: 878 | t281 = 0.1e1_dp/t279/t16 | ^ Warning: ‘t16’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:665:53: 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & | ^ note: ‘t16’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1102:29: 1102 | t835 = t159**2 | ^ Warning: ‘t159’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:665:48: 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & | ^ note: ‘t159’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1144:37: 1144 | *t389*t573*t748 | ^ Warning: ‘t156’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:665:42: 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & | ^ note: ‘t156’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:989:48: 989 | + t213)*sc | ^ Warning: ‘t155’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:665:36: 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & | ^ note: ‘t155’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1085:31: 1085 | t745 = t154*t451 | ^ Warning: ‘t154’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:665:30: 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & | ^ note: ‘t154’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:981:31: 981 | t464 = t342*t151 | ^ Warning: ‘t151’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:665:24: 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & | ^ note: ‘t151’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:982:30: 982 | t467 = t150*t43 | ^ Warning: ‘t150’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:665:18: 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & | ^ note: ‘t150’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:979:31: 979 | t458 = t333*t147 | ^ Warning: ‘t147’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:664:96: 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & | ^ note: ‘t147’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:980:30: 980 | t461 = t145*t43 | ^ Warning: ‘t145’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:664:84: 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & | ^ note: ‘t145’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:974:35: 974 | t455 = 0.2e1_dp*t144 | ^ Warning: ‘t144’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:664:78: 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & | ^ note: ‘t144’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1062:51: 1062 | t133*t10 + 0.2e1_dp*t307*t105 | ^ Warning: ‘t137’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:664:67: 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & | ^ note: ‘t137’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:899:31: 899 | t319 = t136*t245 | ^ Warning: ‘t136’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:664:61: 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & | ^ note: ‘t136’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1062:51: 1062 | t133*t10 + 0.2e1_dp*t307*t105 | ^ Warning: ‘t134’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:664:55: 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & | ^ note: ‘t134’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:893:31: 893 | t307 = t306*t133 | ^ Warning: ‘t133’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:664:49: 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & | ^ note: ‘t133’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:895:31: 895 | t310 = t132*t309 | ^ Warning: ‘t132’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:664:43: 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & | ^ note: ‘t132’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:892:43: 892 | t302*t237 - t130*t251 | ^ Warning: ‘t130’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:664:37: 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & | ^ note: ‘t130’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:972:67: 972 | *t443*t408)*t80) - t332 | ^ Warning: ‘t127’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:664:31: 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & | ^ note: ‘t127’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:888:31: 888 | t299 = t126*t230 | ^ Warning: ‘t126’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:664:25: 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & | ^ note: ‘t126’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1051:39: 1051 | *t531 - t130*t549 | ^ Warning: ‘t125’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:664:19: 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & | ^ note: ‘t125’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:876:31: 876 | t276 = t231*t120 | ^ Warning: ‘t120’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:663:91: 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & | ^ note: ‘t120’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1038:41: 1038 | t603 = t500/t284/t119*t601 | ^ Warning: ‘t119’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:663:85: 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & | ^ note: ‘t119’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1037:29: 1037 | t601 = t117**2 | ^ Warning: ‘t117’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:663:79: 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & | ^ note: ‘t117’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1078:40: 1078 | *bp*t625*t565*t559 | ^ Warning: ‘t116’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:663:73: 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & | ^ note: ‘t116’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:875:31: 875 | t273 = t115*t245 | ^ Warning: ‘t115’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:663:67: 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & | ^ note: ‘t115’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1028:40: 1028 | t563 = 0.1e1_dp/t279/t113 | ^ Warning: ‘t113’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:663:55: 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & | ^ note: ‘t113’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1078:40: 1078 | *bp*t625*t565*t559 | ^ Warning: ‘t110’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:663:49: 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & | ^ note: ‘t110’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:758:28: 758 | t89 = t88*t11 | ^ Warning: ‘t11’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:663:43: 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & | ^ note: ‘t11’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:866:31: 866 | t255 = t254*t109 | ^ Warning: ‘t109’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:663:38: 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & | ^ note: ‘t109’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:868:31: 868 | t259 = t108*t258 | ^ Warning: ‘t108’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:663:32: 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & | ^ note: ‘t108’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:908:60: 908 | *t325*t287)*t38) | ^ Warning: ‘t105’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:663:26: 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & | ^ note: ‘t105’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:1026:62: 1026 | *t246*t509 - 0.9531842928e0_dp*t102*t522 | ^ Warning: ‘t102’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:663:13: 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & | ^ note: ‘t102’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:885:31: 885 | t292 = t291*t101 | ^ Warning: ‘t101’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:662:85: 662 | REAL(KIND=dp) :: ap, bp, cp, myrho, myrhoa, myrhob, Qf, Qp, t1, t10, t100, t101, t1019, & | ^ note: ‘t101’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:792:82: 792 | t121 - t24*(t134*t10 + 0.3177280975e0_dp*t137*t121)*t38) | ^ Warning: ‘t10’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F:662:73: 662 | REAL(KIND=dp) :: ap, bp, cp, myrho, myrhoa, myrhob, Qf, Qp, t1, t10, t100, t101, t1019, & | ^ note: ‘t10’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_vwn.mod' due to: xc_vwn.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_vwn.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod input_section_types.mod xc_rho_set_types.mod base_hooks.mod xc_functionals_utilities.mod kinds.mod bibliography.mod xc_input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_xbr_pbe_lda_hole_t_c_lr.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbr_pbe_lda_hole_t_c_lr.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod xc_xlda_hole_t_c_lr.mod mathconstants.mod xc_xbecke_roussel.mod xc_xpbe_hole_t_c_lr.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbr_pbe_lda_hole_t_c_lr.F xc_xbr_pbe_lda_hole_t_c_lr.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:59:49 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xbr_pbe_lda_hole_t_c_lr.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xbr_pbe_lda_hole_t_c_lr.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_xbr_pbe_lda_hole_t_c_lr.mod' due to: xc_xbr_pbe_lda_hole_t_c_lr.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_xbr_pbe_lda_hole_t_c_lr.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod xc_xlda_hole_t_c_lr.mod mathconstants.mod xc_xbecke_roussel.mod xc_xpbe_hole_t_c_lr.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_tfw.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_tfw.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod base_hooks.mod xc_functionals_utilities.mod kinds.mod cp_array_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_tfw.F xc_tfw.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:59:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_tfw.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_tfw.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_tfw.mod' due to: xc_tfw.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_tfw.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod base_hooks.mod xc_functionals_utilities.mod kinds.mod cp_array_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_thomas_fermi.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_thomas_fermi.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod base_hooks.mod xc_functionals_utilities.mod kinds.mod cp_array_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_thomas_fermi.F xc_thomas_fermi.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:59:53 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_thomas_fermi.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_thomas_fermi.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_thomas_fermi.mod' due to: xc_thomas_fermi.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_thomas_fermi.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod base_hooks.mod xc_functionals_utilities.mod kinds.mod cp_array_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_libxc_wrap.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_libxc_wrap.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod cp_log_handling.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_libxc_wrap.F xc_libxc_wrap.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:59:55 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_libxc_wrap.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_libxc_wrap.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_libxc_wrap.mod' due to: xc_libxc_wrap.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_libxc_wrap.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod cp_log_handling.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_libxc.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_libxc.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod xc_libxc_wrap.mod base_hooks.mod kinds.mod bibliography.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_libxc.F xc_libxc.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 21:59:56 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_libxc.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_libxc.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_libxc.mod' due to: xc_libxc.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_libxc.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod xc_libxc_wrap.mod base_hooks.mod kinds.mod bibliography.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_derivatives.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_derivatives.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod input_section_types.mod xc_derivative_set_types.mod xc_rho_set_types.mod xc_perdew86.mod xc_xpbe_hole_t_c_lr.mod xc_pbe.mod xc_pade.mod xc_optx.mod xc_exchange_gga.mod kinds.mod xc_perdew_wang.mod xc_xbecke88_long_range.mod xc_sr_lda.mod xc_lyp.mod xc_ke_gga.mod xc_xbecke88.mod xc_b97.mod base_hooks.mod xc_hcth.mod xc_lyp_adiabatic.mod xc_xlda_hole_t_c_lr.mod xc_xbeef.mod xc_xbecke_roussel.mod xc_xbecke88_lr_adiabatic.mod xc_xalpha.mod xc_tpss.mod xc_xwpbe.mod xc_cs1.mod xc_vwn.mod xc_xbr_pbe_lda_hole_t_c_lr.mod xc_perdew_zunger.mod xc_tfw.mod xc_thomas_fermi.mod xc_libxc.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_derivatives.F xc_derivatives.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:00:05 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_derivatives.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_derivatives.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_derivatives.mod' due to: xc_derivatives.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_derivatives.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod input_section_types.mod xc_derivative_set_types.mod xc_rho_set_types.mod xc_perdew86.mod xc_xpbe_hole_t_c_lr.mod xc_pbe.mod xc_pade.mod xc_optx.mod xc_exchange_gga.mod kinds.mod xc_perdew_wang.mod xc_xbecke88_long_range.mod xc_sr_lda.mod xc_lyp.mod xc_ke_gga.mod xc_xbecke88.mod xc_b97.mod base_hooks.mod xc_hcth.mod xc_lyp_adiabatic.mod xc_xlda_hole_t_c_lr.mod xc_xbeef.mod xc_xbecke_roussel.mod xc_xbecke88_lr_adiabatic.mod xc_xalpha.mod xc_tpss.mod xc_xwpbe.mod xc_cs1.mod xc_vwn.mod xc_xbr_pbe_lda_hole_t_c_lr.mod xc_perdew_zunger.mod xc_tfw.mod xc_thomas_fermi.mod xc_libxc.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod xc_derivative_types.mod input_section_types.mod pw_pool_types.mod xc_derivative_set_types.mod xc_rho_set_types.mod cp_array_utils.mod pw_methods.mod xc_input_constants.mod xc_derivative_desc.mod kinds.mod base_hooks.mod cp_log_handling.mod kahan_sum.mod cp_linked_list_xc_deriv.mod message_passing.mod pw_spline_utils.mod xc_derivatives.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc.F xc.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:00:12 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc.F:1558:22: 1558 | IF (dealloc_pw_to_deriv) THEN | ^ Warning: ‘dealloc_pw_to_deriv’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc.mod' due to: xc.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod xc_derivative_types.mod input_section_types.mod pw_pool_types.mod xc_derivative_set_types.mod xc_rho_set_types.mod cp_array_utils.mod pw_methods.mod xc_input_constants.mod xc_derivative_desc.mod kinds.mod base_hooks.mod cp_log_handling.mod kahan_sum.mod cp_linked_list_xc_deriv.mod message_passing.mod pw_spline_utils.mod xc_derivatives.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_atom.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_atom.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod pw_pool_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod pw_types.mod base_hooks.mod kinds.mod cp_linked_list_xc_deriv.mod xc.mod xc_derivatives.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_atom.F xc_atom.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:00:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_atom.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/xc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_atom.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_atom.mod' due to: xc_atom.o /build/cp2k-Q381vr/cp2k-8.1/src/xc/xc_atom.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod pw_pool_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod pw_types.mod base_hooks.mod kinds.mod cp_linked_list_xc_deriv.mod xc.mod xc_derivatives.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_vxc_atom.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_vxc_atom.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod qs_local_rho_types.mod qs_kind_types.mod atomic_kind_types.mod basis_set_types.mod cp_control_types.mod qs_energy_types.mod qs_linres_types.mod qs_rho_atom_types.mod paw_proj_set_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod xc_derivative_set_types.mod xc_rho_set_types.mod xc_atom.mod input_constants.mod kinds.mod base_hooks.mod util.mod qs_grid_atom.mod qs_harmonics_atom.mod memory_utilities.mod orbital_pointers.mod message_passing.mod xc_derivatives.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_vxc_atom.F qs_vxc_atom.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:00:33 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_vxc_atom.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_vxc_atom.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_vxc_atom.F:318:105: 318 | ir, rho_nlcc(:, 1), rho_h, rho_s, rho_nlcc(:, 2), drho_h, drho_s) | ^ Warning: ‘rho_nlcc.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_vxc_atom.F:113:75: 113 | REAL(dp), DIMENSION(:, :), POINTER :: rho_h, rho_nlcc, rho_s, weight | ^ Warning: ‘rho_nlcc.dim[1].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_vxc_atom.F:113:75: Warning: ‘rho_nlcc.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_vxc_atom.F:113:75: Warning: ‘rho_nlcc.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_vxc_atom.mod' due to: qs_vxc_atom.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_vxc_atom.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod qs_local_rho_types.mod qs_kind_types.mod atomic_kind_types.mod basis_set_types.mod cp_control_types.mod qs_energy_types.mod qs_linres_types.mod qs_rho_atom_types.mod paw_proj_set_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod xc_derivative_set_types.mod xc_rho_set_types.mod xc_atom.mod input_constants.mod kinds.mod base_hooks.mod util.mod qs_grid_atom.mod qs_harmonics_atom.mod memory_utilities.mod orbital_pointers.mod message_passing.mod xc_derivatives.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pme_tools.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pme_tools.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod atomic_kind_types.mod realspace_grid_types.mod cell_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pme_tools.F pme_tools.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:00:49 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pme_tools.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pme_tools.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pme_tools.mod' due to: pme_tools.o /build/cp2k-Q381vr/cp2k-8.1/src/pme_tools.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod atomic_kind_types.mod realspace_grid_types.mod cell_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'spme.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/spme.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod shell_potential_types.mod realspace_grid_types.mod atprop_types.mod particle_types.mod ewald_environment_types.mod pw_pool_types.mod pw_poisson_types.mod ewald_pw_types.mod pme_tools.mod dgs.mod pw_methods.mod pw_poisson_methods.mod kinds.mod bibliography.mod base_hooks.mod mathconstants.mod pw_grids.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/spme.F spme.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:00:49 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"spme.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' spme.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'spme.mod' due to: spme.o /build/cp2k-Q381vr/cp2k-8.1/src/spme.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod shell_potential_types.mod realspace_grid_types.mod atprop_types.mod particle_types.mod ewald_environment_types.mod pw_pool_types.mod pw_poisson_types.mod ewald_pw_types.mod pme_tools.mod dgs.mod pw_methods.mod pw_poisson_methods.mod kinds.mod bibliography.mod base_hooks.mod mathconstants.mod pw_grids.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'virial_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/virial_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cp_para_types.mod distribution_1d_types.mod particle_types.mod atomic_kind_list_types.mod virial_types.mod atomic_kind_types.mod particle_list_types.mod cell_types.mod base_hooks.mod kinds.mod mathlib.mod physcon.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/virial_methods.F virial_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:00:53 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"virial_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' virial_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'virial_methods.mod' due to: virial_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/virial_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cp_para_types.mod distribution_1d_types.mod particle_types.mod atomic_kind_list_types.mod virial_types.mod atomic_kind_types.mod particle_list_types.mod cell_types.mod base_hooks.mod kinds.mod mathlib.mod physcon.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ewald_methods_tb.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/ewald_methods_tb.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod cell_types.mod pw_types.mod virial_types.mod realspace_grid_types.mod atprop_types.mod particle_types.mod ewald_environment_types.mod cp_para_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_poisson_types.mod ewald_pw_types.mod pme_tools.mod dgs.mod pw_methods.mod spme.mod pw_poisson_methods.mod kinds.mod base_hooks.mod mathconstants.mod virial_methods.mod pw_grids.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/ewald_methods_tb.F ewald_methods_tb.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:00:55 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ewald_methods_tb.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ewald_methods_tb.F90 /build/cp2k-Q381vr/cp2k-8.1/src/ewald_methods_tb.F:392:58: 392 | pfr = -dfr*mcharge(iatom)*mcharge(jatom) | ^ Warning: ‘dfr’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ewald_methods_tb.mod' due to: ewald_methods_tb.o /build/cp2k-Q381vr/cp2k-8.1/src/ewald_methods_tb.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod cell_types.mod pw_types.mod virial_types.mod realspace_grid_types.mod atprop_types.mod particle_types.mod ewald_environment_types.mod cp_para_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_poisson_types.mod ewald_pw_types.mod pme_tools.mod dgs.mod pw_methods.mod spme.mod pw_poisson_methods.mod kinds.mod base_hooks.mod mathconstants.mod virial_methods.mod pw_grids.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmm_tb_coulomb.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_tb_coulomb.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cell_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod atprop_types.mod qs_rho_types.mod particle_types.mod ewald_environment_types.mod cp_para_types.mod qs_environment_types.mod qmmm_types_low.mod pw_poisson_types.mod distribution_1d_types.mod ewald_pw_types.mod kinds.mod base_hooks.mod mathconstants.mod ewald_methods_tb.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_tb_coulomb.F qmmm_tb_coulomb.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:00:56 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_tb_coulomb.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_tb_coulomb.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmm_tb_coulomb.mod' due to: qmmm_tb_coulomb.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_tb_coulomb.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cell_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod atprop_types.mod qs_rho_types.mod particle_types.mod ewald_environment_types.mod cp_para_types.mod qs_environment_types.mod qmmm_types_low.mod pw_poisson_types.mod distribution_1d_types.mod ewald_pw_types.mod kinds.mod base_hooks.mod mathconstants.mod ewald_methods_tb.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ai_contraction.mod' due to: ai_contraction.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_dftb3_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb3_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 sap_kind_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod qs_force_types.mod virial_types.mod qs_energy_types.mod kpoint_types.mod atprop_types.mod qs_rho_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod distribution_1d_types.mod kinds.mod base_hooks.mod message_passing.mod virial_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb3_methods.F qs_dftb3_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:00:59 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dftb3_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dftb3_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_dftb3_methods.mod' due to: qs_dftb3_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb3_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 sap_kind_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod qs_force_types.mod virial_types.mod qs_energy_types.mod kpoint_types.mod atprop_types.mod qs_rho_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod distribution_1d_types.mod kinds.mod base_hooks.mod message_passing.mod virial_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xtb_coulomb.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xtb_coulomb.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 sap_kind_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod xtb_types.mod qs_energy_types.mod kpoint_types.mod atprop_types.mod qs_rho_types.mod particle_types.mod ewald_environment_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_poisson_types.mod distribution_1d_types.mod ewald_pw_types.mod qmmm_tb_coulomb.mod ai_overlap.mod kinds.mod base_hooks.mod mathconstants.mod ai_contraction.mod ewald_methods_tb.mod qs_integral_utils.mod orbital_pointers.mod qs_dftb3_methods.mod message_passing.mod virial_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xtb_coulomb.F xtb_coulomb.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:01:03 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xtb_coulomb.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xtb_coulomb.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xtb_coulomb.mod' due to: xtb_coulomb.o /build/cp2k-Q381vr/cp2k-8.1/src/xtb_coulomb.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 sap_kind_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod xtb_types.mod qs_energy_types.mod kpoint_types.mod atprop_types.mod qs_rho_types.mod particle_types.mod ewald_environment_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_poisson_types.mod distribution_1d_types.mod ewald_pw_types.mod qmmm_tb_coulomb.mod ai_overlap.mod kinds.mod base_hooks.mod mathconstants.mod ai_contraction.mod ewald_methods_tb.mod qs_integral_utils.mod orbital_pointers.mod qs_dftb3_methods.mod message_passing.mod virial_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xtb_ehess.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xtb_ehess.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod cp_control_types.mod virial_types.mod xtb_types.mod atprop_types.mod particle_types.mod ewald_environment_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_poisson_types.mod distribution_1d_types.mod ewald_pw_types.mod kinds.mod base_hooks.mod mathconstants.mod ewald_methods_tb.mod xtb_coulomb.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xtb_ehess.F xtb_ehess.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:01:14 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xtb_ehess.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xtb_ehess.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xtb_ehess.mod' due to: xtb_ehess.o /build/cp2k-Q381vr/cp2k-8.1/src/xtb_ehess.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod cp_control_types.mod virial_types.mod xtb_types.mod atprop_types.mod particle_types.mod ewald_environment_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_poisson_types.mod distribution_1d_types.mod ewald_pw_types.mod kinds.mod base_hooks.mod mathconstants.mod ewald_methods_tb.mod xtb_coulomb.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'hartree_local_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/hartree_local_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_local_rho_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod cp_control_types.mod qs_charges_types.mod atprop_types.mod qs_rho_atom_types.mod cp_para_types.mod qs_environment_types.mod qs_rho0_types.mod pw_env_types.mod pw_poisson_types.mod hartree_local_types.mod kinds.mod base_hooks.mod util.mod mathconstants.mod qs_grid_atom.mod qs_harmonics_atom.mod orbital_pointers.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/hartree_local_methods.F hartree_local_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:01:18 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hartree_local_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hartree_local_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'hartree_local_methods.mod' due to: hartree_local_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/hartree_local_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_local_rho_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod cp_control_types.mod qs_charges_types.mod atprop_types.mod qs_rho_atom_types.mod cp_para_types.mod qs_environment_types.mod qs_rho0_types.mod pw_env_types.mod pw_poisson_types.mod hartree_local_types.mod kinds.mod base_hooks.mod util.mod mathconstants.mod qs_grid_atom.mod qs_harmonics_atom.mod orbital_pointers.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_dbcsr_cp2k_link.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/cp_dbcsr_cp2k_link.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod input_keyword_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_dbcsr_operations.mod bibliography.mod qs_integral_utils.mod orbital_pointers.mod string_utilities.mod ao_util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/cp_dbcsr_cp2k_link.F cp_dbcsr_cp2k_link.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:01:25 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_dbcsr_cp2k_link.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_dbcsr_cp2k_link.F90 /build/cp2k-Q381vr/cp2k-8.1/src/cp_dbcsr_cp2k_link.F:509:13: 509 | IF (jatom /= last_jatom) THEN | ^ Warning: ‘last_jatom’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_dbcsr_cp2k_link.mod' due to: cp_dbcsr_cp2k_link.o /build/cp2k-Q381vr/cp2k-8.1/src/cp_dbcsr_cp2k_link.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod input_keyword_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_dbcsr_operations.mod bibliography.mod qs_integral_utils.mod orbital_pointers.mod string_utilities.mod ao_util.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_collocate_density.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_collocate_density.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod lri_environment_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod realspace_grid_types.mod task_list_types.mod particle_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod external_potential_types.mod pw_methods.mod input_constants.mod kinds.mod base_hooks.mod rs_pw_interface.mod ao_util.mod task_list_methods.mod gaussian_gridlevels.mod memory_utilities.mod cube_utils.mod orbital_pointers.mod grid_api.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_collocate_density.F qs_collocate_density.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:01:28 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_collocate_density.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_collocate_density.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_collocate_density.F:1926:10: 1926 | IF (distributed_rs_grids) THEN | ^ Warning: ‘distributed_rs_grids’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_collocate_density.mod' due to: qs_collocate_density.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_collocate_density.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod lri_environment_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod realspace_grid_types.mod task_list_types.mod particle_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod external_potential_types.mod pw_methods.mod input_constants.mod kinds.mod base_hooks.mod rs_pw_interface.mod ao_util.mod task_list_methods.mod gaussian_gridlevels.mod memory_utilities.mod cube_utils.mod orbital_pointers.mod grid_api.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_overlap.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_overlap.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod basis_set_types.mod qs_force_types.mod block_p_types.mod cp_control_types.mod virial_types.mod kpoint_types.mod particle_types.mod qs_neighbor_list_types.mod cp_dbcsr_cp2k_link.mod string_utilities.mod particle_methods.mod ai_overlap.mod kinds.mod base_hooks.mod orbital_symbols.mod ai_contraction.mod qs_integral_utils.mod orbital_pointers.mod virial_methods.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_overlap.F qs_overlap.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:01:36 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_overlap.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_overlap.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_overlap.F:312:46: 312 | !$OMP REDUCTION (+ : pv_thread, force_thread ) | ^ Warning: ‘use_virial’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_overlap.F:312:46: Warning: ‘use_cell_mapping’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_overlap.F:522:10: 522 | IF (dokp) THEN | ^ Warning: ‘dokp’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_overlap.mod' due to: qs_overlap.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_overlap.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod basis_set_types.mod qs_force_types.mod block_p_types.mod cp_control_types.mod virial_types.mod kpoint_types.mod particle_types.mod qs_neighbor_list_types.mod cp_dbcsr_cp2k_link.mod string_utilities.mod particle_methods.mod ai_overlap.mod kinds.mod base_hooks.mod orbital_symbols.mod ai_contraction.mod qs_integral_utils.mod orbital_pointers.mod virial_methods.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ai_overlap3.mod' due to: ai_overlap3.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ai_contraction_sphi.mod' due to: ai_contraction_sphi.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_o3c_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_o3c_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_o3c_types.mod base_hooks.mod kinds.mod ai_overlap3.mod orbital_pointers.mod ai_contraction_sphi.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_o3c_methods.F qs_o3c_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:01:41 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_o3c_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_o3c_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_o3c_methods.mod' due to: qs_o3c_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_o3c_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_o3c_types.mod base_hooks.mod kinds.mod ai_overlap3.mod orbital_pointers.mod ai_contraction_sphi.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ri_environment_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/ri_environment_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod lri_environment_types.mod atomic_kind_types.mod pw_types.mod cp_control_types.mod qs_rho_types.mod cp_para_types.mod qs_environment_types.mod qs_o3c_types.mod arnoldi_api.mod cp_dbcsr_cp2k_link.mod kinds.mod cp_blacs_env.mod qs_collocate_density.mod cp_dbcsr_diag.mod base_hooks.mod util.mod qs_overlap.mod qs_o3c_methods.mod iterate_matrix.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/ri_environment_methods.F ri_environment_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:01:47 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ri_environment_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ri_environment_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/ri_environment_methods.F:626:23: 626 | IF (symm .AND. (iatom /= jatom)) THEN | ^ Warning: ‘symm’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ri_environment_methods.mod' due to: ri_environment_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/ri_environment_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod lri_environment_types.mod atomic_kind_types.mod pw_types.mod cp_control_types.mod qs_rho_types.mod cp_para_types.mod qs_environment_types.mod qs_o3c_types.mod arnoldi_api.mod cp_dbcsr_cp2k_link.mod kinds.mod cp_blacs_env.mod qs_collocate_density.mod cp_dbcsr_diag.mod base_hooks.mod util.mod qs_overlap.mod qs_o3c_methods.mod iterate_matrix.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ai_operators_r12.mod' due to: ai_operators_r12.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ai_overlap_aabb.mod' due to: ai_overlap_aabb.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'constants_operator.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/shg_int/constants_operator.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/shg_int/constants_operator.F constants_operator.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:01:53 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"shg_int/constants_operator.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/shg_int/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' constants_operator.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'constants_operator.mod' due to: constants_operator.o /build/cp2k-Q381vr/cp2k-8.1/src/shg_int/constants_operator.F true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ai_overlap3_debug.mod' due to: ai_overlap3_debug.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'debug_os_integrals.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/debug_os_integrals.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod ai_overlap3.mod ai_overlap_aabb.mod ai_overlap3_debug.mod orbital_pointers.mod ai_overlap.mod ai_overlap_debug.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/debug_os_integrals.F debug_os_integrals.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:01:53 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"debug_os_integrals.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' debug_os_integrals.F90 /build/cp2k-Q381vr/cp2k-8.1/src/debug_os_integrals.F:46:36: 46 | SUBROUTINE overlap_ab_test_simple() | ^ Warning: ‘overlap_ab_test_simple’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/debug_os_integrals.F:191:37: 191 | SUBROUTINE overlap_abc_test_simple() | ^ Warning: ‘overlap_abc_test_simple’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/debug_os_integrals.F:386:38: 386 | SUBROUTINE overlap_aabb_test_simple() | ^ Warning: ‘overlap_aabb_test_simple’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'debug_os_integrals.mod' due to: debug_os_integrals.o /build/cp2k-Q381vr/cp2k-8.1/src/debug_os_integrals.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod ai_overlap3.mod ai_overlap_aabb.mod ai_overlap3_debug.mod orbital_pointers.mod ai_overlap.mod ai_overlap_debug.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ai_operator_ra2m.mod' due to: ai_operator_ra2m.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'generic_os_integrals.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/generic_os_integrals.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod base_hooks.mod ai_operators_r12.mod kinds.mod ai_overlap_aabb.mod constants_operator.mod ai_derivatives.mod debug_os_integrals.mod orbital_pointers.mod ai_contraction_sphi.mod ai_operator_ra2m.mod ai_overlap.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/generic_os_integrals.F generic_os_integrals.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:01:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"generic_os_integrals.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' generic_os_integrals.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'generic_os_integrals.mod' due to: generic_os_integrals.o /build/cp2k-Q381vr/cp2k-8.1/src/generic_os_integrals.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod base_hooks.mod ai_operators_r12.mod kinds.mod ai_overlap_aabb.mod constants_operator.mod ai_derivatives.mod debug_os_integrals.mod orbital_pointers.mod ai_contraction_sphi.mod ai_operator_ra2m.mod ai_overlap.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'lri_compression.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/lri_compression.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 lri_environment_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/lri_compression.F lri_compression.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:02:01 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_compression.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_compression.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'lri_compression.mod' due to: lri_compression.o /build/cp2k-Q381vr/cp2k-8.1/src/lri_compression.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 lri_environment_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ai_overlap_ppl.mod' due to: ai_overlap_ppl.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'core_ppl.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/core_ppl.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_force_types.mod qs_neighbor_list_types.mod external_potential_types.mod particle_types.mod qs_kind_types.mod lri_environment_types.mod atomic_kind_types.mod virial_types.mod base_hooks.mod kinds.mod orbital_pointers.mod virial_methods.mod ai_overlap_ppl.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/core_ppl.F core_ppl.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:02:02 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"core_ppl.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' core_ppl.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'core_ppl.mod' due to: core_ppl.o /build/cp2k-Q381vr/cp2k-8.1/src/core_ppl.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_force_types.mod qs_neighbor_list_types.mod external_potential_types.mod particle_types.mod qs_kind_types.mod lri_environment_types.mod atomic_kind_types.mod virial_types.mod base_hooks.mod kinds.mod orbital_pointers.mod virial_methods.mod ai_overlap_ppl.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'construct_shg.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/shg_int/construct_shg.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/shg_int/construct_shg.F construct_shg.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:02:11 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"shg_int/construct_shg.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/shg_int/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' construct_shg.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'construct_shg.mod' due to: construct_shg.o /build/cp2k-Q381vr/cp2k-8.1/src/shg_int/construct_shg.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod orbital_pointers.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 's_contract_shg.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/shg_int/s_contract_shg.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 gamma.mod mathconstants.mod kinds.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/shg_int/s_contract_shg.F s_contract_shg.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:02:16 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"shg_int/s_contract_shg.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/shg_int/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' s_contract_shg.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 's_contract_shg.mod' due to: s_contract_shg.o /build/cp2k-Q381vr/cp2k-8.1/src/shg_int/s_contract_shg.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 gamma.mod mathconstants.mod kinds.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'generic_shg_integrals.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/shg_int/generic_shg_integrals.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod base_hooks.mod kinds.mod constants_operator.mod construct_shg.mod s_contract_shg.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/shg_int/generic_shg_integrals.F generic_shg_integrals.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:02:22 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"shg_int/generic_shg_integrals.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/shg_int/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' generic_shg_integrals.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'generic_shg_integrals.mod' due to: generic_shg_integrals.o /build/cp2k-Q381vr/cp2k-8.1/src/shg_int/generic_shg_integrals.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod base_hooks.mod kinds.mod constants_operator.mod construct_shg.mod s_contract_shg.mod orbital_pointers.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'lri_integrals.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/lri_integrals.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod lri_environment_types.mod base_hooks.mod kinds.mod generic_os_integrals.mod generic_shg_integrals.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/lri_integrals.F lri_integrals.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:02:32 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_integrals.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_integrals.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'lri_integrals.mod' due to: lri_integrals.o /build/cp2k-Q381vr/cp2k-8.1/src/lri_integrals.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod lri_environment_types.mod base_hooks.mod kinds.mod generic_os_integrals.mod generic_shg_integrals.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'lri_environment_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/lri_environment_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod lri_environment_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod basis_set_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod qs_rho_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod mathlib.mod input_constants.mod kinds.mod cp_output_handling.mod generic_os_integrals.mod lri_compression.mod qs_collocate_density.mod base_hooks.mod core_ppl.mod cp_log_handling.mod lri_integrals.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/lri_environment_methods.F lri_environment_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:02:35 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_environment_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_environment_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/lri_environment_methods.F:481:40: 481 | SUBROUTINE calculate_lri_overlap_aabb(lri_env, qs_env) | ^ Warning: ‘calculate_lri_overlap_aabb’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/lri_environment_methods.F:399:65: 399 | nspin | ^ Warning: ‘nspin’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'lri_environment_methods.mod' due to: lri_environment_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/lri_environment_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod lri_environment_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod basis_set_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod qs_rho_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod mathlib.mod input_constants.mod kinds.mod cp_output_handling.mod generic_os_integrals.mod lri_compression.mod qs_collocate_density.mod base_hooks.mod core_ppl.mod cp_log_handling.mod lri_integrals.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_oce_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_oce_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod sap_kind_types.mod block_p_types.mod qs_neighbor_list_types.mod particle_types.mod paw_proj_set_types.mod qs_kind_types.mod base_hooks.mod kinds.mod mathconstants.mod orbital_transformation_matrices.mod orbital_pointers.mod ai_overlap.mod ao_util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_oce_methods.F qs_oce_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:02:45 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_oce_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_oce_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_oce_methods.F:84:58: 84 | maxder, maxlb, maxlprj, maxnprja, maxsoa, msab, n, ncob, np_car, np_sph, nsatbas, nseta, & | ^ Warning: ‘n’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_oce_methods.F:548:40: 548 | clist%nsgf_cnt = nsgf_cnt | ^ Warning: ‘nsgf_cnt’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_oce_methods.mod' due to: qs_oce_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_oce_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod sap_kind_types.mod block_p_types.mod qs_neighbor_list_types.mod particle_types.mod paw_proj_set_types.mod qs_kind_types.mod base_hooks.mod kinds.mod mathconstants.mod orbital_transformation_matrices.mod orbital_pointers.mod ai_overlap.mod ao_util.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_rho_atom_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho_atom_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 sap_kind_types.mod qs_kind_types.mod atomic_kind_types.mod basis_set_types.mod cp_control_types.mod kpoint_types.mod qs_rho_atom_types.mod paw_proj_set_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_oce_types.mod spherical_harmonics.mod kinds.mod whittaker.mod base_hooks.mod util.mod mathconstants.mod lebedev.mod qs_grid_atom.mod qs_oce_methods.mod qs_harmonics_atom.mod memory_utilities.mod orbital_pointers.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho_atom_methods.F qs_rho_atom_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:02:52 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_rho_atom_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_rho_atom_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_rho_atom_methods.mod' due to: qs_rho_atom_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho_atom_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 sap_kind_types.mod qs_kind_types.mod atomic_kind_types.mod basis_set_types.mod cp_control_types.mod kpoint_types.mod qs_rho_atom_types.mod paw_proj_set_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_oce_types.mod spherical_harmonics.mod kinds.mod whittaker.mod base_hooks.mod util.mod mathconstants.mod lebedev.mod qs_grid_atom.mod qs_oce_methods.mod qs_harmonics_atom.mod memory_utilities.mod orbital_pointers.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_rho_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_local_rho_types.mod qs_kind_types.mod qs_ks_types.mod lri_environment_types.mod atomic_kind_types.mod pw_types.mod cp_control_types.mod kpoint_types.mod qs_rho_types.mod task_list_types.mod qs_rho_atom_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod qs_oce_types.mod cp_dbcsr_cp2k_link.mod ri_environment_methods.mod pw_methods.mod lri_environment_methods.mod kinds.mod qs_collocate_density.mod base_hooks.mod qs_rho_atom_methods.mod cp_log_handling.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho_methods.F qs_rho_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:03:05 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_rho_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_rho_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_rho_methods.mod' due to: qs_rho_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_local_rho_types.mod qs_kind_types.mod qs_ks_types.mod lri_environment_types.mod atomic_kind_types.mod pw_types.mod cp_control_types.mod kpoint_types.mod qs_rho_types.mod task_list_types.mod qs_rho_atom_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod qs_oce_types.mod cp_dbcsr_cp2k_link.mod ri_environment_methods.mod pw_methods.mod lri_environment_methods.mod kinds.mod qs_collocate_density.mod base_hooks.mod qs_rho_atom_methods.mod cp_log_handling.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_hash_table_functions.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_hash_table_functions.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_hash_table_functions.F qs_hash_table_functions.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:03:11 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_hash_table_functions.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_hash_table_functions.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_hash_table_functions.mod' due to: qs_hash_table_functions.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_hash_table_functions.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_nl_hash_table_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_nl_hash_table_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod base_hooks.mod qs_hash_table_functions.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_nl_hash_table_types.F qs_nl_hash_table_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:03:12 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_nl_hash_table_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_nl_hash_table_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_nl_hash_table_types.mod' due to: qs_nl_hash_table_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_nl_hash_table_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod base_hooks.mod qs_hash_table_functions.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_ks_atom.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_atom.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 sap_kind_types.mod qs_kind_types.mod atomic_kind_types.mod basis_set_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod kpoint_types.mod qs_nl_hash_table_types.mod qs_rho_atom_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_oce_types.mod cp_array_utils.mod kinds.mod base_hooks.mod util.mod ao_util.mod qs_oce_methods.mod message_passing.mod virial_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_atom.F qs_ks_atom.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:03:12 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ks_atom.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ks_atom.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_ks_atom.mod' due to: qs_ks_atom.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_atom.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 sap_kind_types.mod qs_kind_types.mod atomic_kind_types.mod basis_set_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod kpoint_types.mod qs_nl_hash_table_types.mod qs_rho_atom_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_oce_types.mod cp_array_utils.mod kinds.mod base_hooks.mod util.mod ao_util.mod qs_oce_methods.mod message_passing.mod virial_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'lri_forces.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/lri_forces.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod kpoint_types.mod qs_environment_types.mod qs_force_types.mod qs_neighbor_list_types.mod qs_o3c_types.mod qs_ks_types.mod virial_types.mod lri_environment_types.mod atomic_kind_types.mod base_hooks.mod kinds.mod lri_integrals.mod virial_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/lri_forces.F lri_forces.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:03:37 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_forces.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_forces.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'lri_forces.mod' due to: lri_forces.o /build/cp2k-Q381vr/cp2k-8.1/src/lri_forces.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod kpoint_types.mod qs_environment_types.mod qs_force_types.mod qs_neighbor_list_types.mod qs_o3c_types.mod qs_ks_types.mod virial_types.mod lri_environment_types.mod atomic_kind_types.mod base_hooks.mod kinds.mod lri_integrals.mod virial_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_dispersion_nonloc.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_nonloc.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_grid_types.mod pw_types.mod pw_pool_types.mod virial_types.mod qs_dispersion_types.mod base_hooks.mod kinds.mod mathconstants.mod bibliography.mod pw_methods.mod message_passing.mod input_constants.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_nonloc.F qs_dispersion_nonloc.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:03:45 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dispersion_nonloc.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dispersion_nonloc.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_nonloc.F:598:61: 598 | REAL(KIND=dp) :: g, g2, g2_last, g_multiplier, gm | ^ Warning: ‘g’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_nonloc.F:854:32: 854 | IF (use_virial .AND. ABS(prefactor) > 0.0_dp) THEN | ^ Warning: ‘prefactor’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_nonloc.F:760:84: 760 | dq_6, e, f, P, prefactor, tmp_1_2, & | ^ note: ‘prefactor’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_nonloc.F:1051:105: 1051 | dq0_dgradrho(i_grid) = total_rho(i_grid)*dq0_dq*2.0_dp*(-Z_ab)/(36.0_dp*kF*total_rho(i_grid)**2) | ^ Warning: ‘z_ab’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_nonloc.F:975:86: 975 | q_min, r_s, sqrt_r_s, Z_ab | ^ note: ‘z_ab’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_nonloc.F:1189:118: 1189 | *(gradient_rho(i_grid, 1)**2 + gradient_rho(i_grid, 2)**2 + gradient_rho(i_grid, 3)**2) | ^ Warning: ‘z_ab’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_nonloc.F:1158:86: 1158 | q_min, r_s, sqrt_r_s, Z_ab | ^ note: ‘z_ab’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_dispersion_nonloc.mod' due to: qs_dispersion_nonloc.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_nonloc.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_grid_types.mod pw_types.mod pw_pool_types.mod virial_types.mod qs_dispersion_types.mod base_hooks.mod kinds.mod mathconstants.mod bibliography.mod pw_methods.mod message_passing.mod input_constants.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_vxc.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_vxc.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_types.mod qs_rho_types.mod pw_pool_types.mod cp_control_types.mod pw_env_types.mod qs_dispersion_types.mod qs_ks_types.mod virial_types.mod cell_types.mod input_section_types.mod base_hooks.mod kinds.mod pw_methods.mod xc.mod input_constants.mod qs_dispersion_nonloc.mod pw_grids.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_vxc.F qs_vxc.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:03:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_vxc.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_vxc.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_vxc.mod' due to: qs_vxc.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_vxc.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_types.mod qs_rho_types.mod pw_pool_types.mod cp_control_types.mod pw_env_types.mod qs_dispersion_types.mod qs_ks_types.mod virial_types.mod cell_types.mod input_section_types.mod base_hooks.mod kinds.mod pw_methods.mod xc.mod input_constants.mod qs_dispersion_nonloc.mod pw_grids.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'lri_ks_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/lri_ks_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod qs_o3c_types.mod lri_environment_types.mod atomic_kind_types.mod base_hooks.mod kinds.mod ri_environment_methods.mod qs_o3c_methods.mod lri_compression.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/lri_ks_methods.F lri_ks_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:03:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_ks_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_ks_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'lri_ks_methods.mod' due to: lri_ks_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/lri_ks_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod qs_o3c_types.mod lri_environment_types.mod atomic_kind_types.mod base_hooks.mod kinds.mod ri_environment_methods.mod qs_o3c_methods.mod lri_compression.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'kg_correction.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/kg_correction.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod qs_ks_types.mod lri_environment_types.mod atomic_kind_types.mod pw_types.mod cp_control_types.mod virial_types.mod qs_rho_types.mod kg_environment_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod xc_derivative_set_types.mod xc_rho_set_types.mod pw_methods.mod input_constants.mod lri_environment_methods.mod qs_integrate_potential.mod lri_forces.mod kinds.mod qs_rho_methods.mod base_hooks.mod xc.mod qs_vxc.mod lri_ks_methods.mod message_passing.mod xc_derivatives.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/kg_correction.F kg_correction.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:03:58 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kg_correction.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kg_correction.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'kg_correction.mod' due to: kg_correction.o /build/cp2k-Q381vr/cp2k-8.1/src/kg_correction.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod qs_ks_types.mod lri_environment_types.mod atomic_kind_types.mod pw_types.mod cp_control_types.mod virial_types.mod qs_rho_types.mod kg_environment_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod xc_derivative_set_types.mod xc_rho_set_types.mod pw_methods.mod input_constants.mod lri_environment_methods.mod qs_integrate_potential.mod lri_forces.mod kinds.mod qs_rho_methods.mod base_hooks.mod xc.mod qs_vxc.mod lri_ks_methods.mod message_passing.mod xc_derivatives.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'realspace_grid_cube.mod' due to: realspace_grid_cube.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_realspace_grid_cube.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/cp_realspace_grid_cube.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod particle_list_types.mod pw_types.mod base_hooks.mod kinds.mod realspace_grid_cube.mod cp_output_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/cp_realspace_grid_cube.F cp_realspace_grid_cube.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:04:04 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_realspace_grid_cube.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_realspace_grid_cube.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_realspace_grid_cube.mod' due to: cp_realspace_grid_cube.o /build/cp2k-Q381vr/cp2k-8.1/src/cp_realspace_grid_cube.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod particle_list_types.mod pw_types.mod base_hooks.mod kinds.mod realspace_grid_cube.mod cp_output_handling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_loc_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod cp_fm_pool_types.mod qs_subsys_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_loc_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod particle_list_types.mod cp_fm_struct.mod qs_matrix_pools.mod qs_loc_utils.mod string_utilities.mod input_constants.mod particle_methods.mod cp_realspace_grid_cube.mod kinds.mod cp_output_handling.mod qs_collocate_density.mod base_hooks.mod mathconstants.mod physcon.mod qs_localization_methods.mod machine.mod cp_units.mod cp_gemm_interface.mod cp_log_handling.mod memory_utilities.mod motion_utils.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_methods.F qs_loc_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:04:04 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_loc_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_loc_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_loc_methods.mod' due to: qs_loc_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod cp_fm_pool_types.mod qs_subsys_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_loc_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod particle_list_types.mod cp_fm_struct.mod qs_matrix_pools.mod qs_loc_utils.mod string_utilities.mod input_constants.mod particle_methods.mod cp_realspace_grid_cube.mod kinds.mod cp_output_handling.mod qs_collocate_density.mod base_hooks.mod mathconstants.mod physcon.mod qs_localization_methods.mod machine.mod cp_units.mod cp_gemm_interface.mod cp_log_handling.mod memory_utilities.mod motion_utils.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_rho0_ggrid.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho0_ggrid.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_local_rho_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod basis_set_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod realspace_grid_types.mod qs_rho_atom_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_rho0_types.mod pw_env_types.mod pw_methods.mod qs_integrate_potential.mod kinds.mod base_hooks.mod util.mod mathconstants.mod qs_harmonics_atom.mod gaussian_gridlevels.mod memory_utilities.mod orbital_transformation_matrices.mod cube_utils.mod orbital_pointers.mod message_passing.mod grid_api.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho0_ggrid.F qs_rho0_ggrid.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:04:10 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_rho0_ggrid.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_rho0_ggrid.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_rho0_ggrid.mod' due to: qs_rho0_ggrid.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho0_ggrid.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_local_rho_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod basis_set_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod realspace_grid_types.mod qs_rho_atom_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_rho0_types.mod pw_env_types.mod pw_methods.mod qs_integrate_potential.mod kinds.mod base_hooks.mod util.mod mathconstants.mod qs_harmonics_atom.mod gaussian_gridlevels.mod memory_utilities.mod orbital_transformation_matrices.mod cube_utils.mod orbital_pointers.mod message_passing.mod grid_api.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_rho0_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho0_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_local_rho_types.mod qs_kind_types.mod atomic_kind_types.mod basis_set_types.mod cp_control_types.mod qs_rho_atom_types.mod input_section_types.mod qs_environment_types.mod qs_rho0_types.mod kinds.mod cp_output_handling.mod base_hooks.mod mathconstants.mod qs_grid_atom.mod ao_util.mod qs_oce_methods.mod qs_harmonics_atom.mod cp_log_handling.mod memory_utilities.mod orbital_transformation_matrices.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho0_methods.F qs_rho0_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:04:14 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_rho0_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_rho0_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho0_methods.F:194:74: 194 | REAL(dp), ALLOCATABLE, DIMENSION(:, :, :) :: cpc_ah, cpc_as | ^ Warning: ‘cpc_as.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho0_methods.F:194:66: 194 | REAL(dp), ALLOCATABLE, DIMENSION(:, :, :) :: cpc_ah, cpc_as | ^ Warning: ‘cpc_ah.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_rho0_methods.mod' due to: qs_rho0_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_rho0_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_local_rho_types.mod qs_kind_types.mod atomic_kind_types.mod basis_set_types.mod cp_control_types.mod qs_rho_atom_types.mod input_section_types.mod qs_environment_types.mod qs_rho0_types.mod kinds.mod cp_output_handling.mod base_hooks.mod mathconstants.mod qs_grid_atom.mod ao_util.mod qs_oce_methods.mod qs_harmonics_atom.mod cp_log_handling.mod memory_utilities.mod orbital_transformation_matrices.mod orbital_pointers.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_gapw_densities.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_gapw_densities.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod qs_local_rho_types.mod qs_rho0_types.mod cp_control_types.mod qs_charges_types.mod qs_rho_atom_types.mod qs_kind_types.mod atomic_kind_types.mod base_hooks.mod kinds.mod cp_log_handling.mod qs_rho_atom_methods.mod qs_rho0_ggrid.mod message_passing.mod qs_rho0_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_gapw_densities.F qs_gapw_densities.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:04:17 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_gapw_densities.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_gapw_densities.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_gapw_densities.mod' due to: qs_gapw_densities.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_gapw_densities.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod qs_local_rho_types.mod qs_rho0_types.mod cp_control_types.mod qs_charges_types.mod qs_rho_atom_types.mod qs_kind_types.mod atomic_kind_types.mod base_hooks.mod kinds.mod cp_log_handling.mod qs_rho_atom_methods.mod qs_rho0_ggrid.mod message_passing.mod qs_rho0_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_linres_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod hfx_types.mod admm_types.mod qs_kind_types.mod qs_ks_types.mod lri_environment_types.mod atomic_kind_types.mod qs_p_env_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod qs_kpp1_env_types.mod xtb_types.mod qs_linres_types.mod qs_rho_types.mod task_list_types.mod kg_environment_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_loc_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_poisson_types.mod xc_rho_set_types.mod preconditioner.mod cp_fm_struct.mod qs_loc_utils.mod pw_methods.mod input_constants.mod cp_fm_vect.mod mulliken.mod hfx_energy_potential.mod pw_poisson_methods.mod qs_integrate_potential.mod cp_external_control.mod qs_vxc_atom.mod kinds.mod xtb_ehess.mod hartree_local_methods.mod cp_output_handling.mod qs_rho_methods.mod qs_collocate_density.mod qs_ks_atom.mod base_hooks.mod string_utilities.mod kg_correction.mod qs_loc_methods.mod machine.mod cp_fm_basic_linalg.mod xc.mod qs_gapw_densities.mod cp_files.mod cp_gemm_interface.mod cp_log_handling.mod lri_ks_methods.mod qs_rho0_ggrid.mod message_passing.mod xc_derivatives.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_methods.F qs_linres_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:04:19 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_linres_methods.mod' due to: qs_linres_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod hfx_types.mod admm_types.mod qs_kind_types.mod qs_ks_types.mod lri_environment_types.mod atomic_kind_types.mod qs_p_env_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod qs_kpp1_env_types.mod xtb_types.mod qs_linres_types.mod qs_rho_types.mod task_list_types.mod kg_environment_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_loc_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_poisson_types.mod xc_rho_set_types.mod preconditioner.mod cp_fm_struct.mod qs_loc_utils.mod pw_methods.mod input_constants.mod cp_fm_vect.mod mulliken.mod hfx_energy_potential.mod pw_poisson_methods.mod qs_integrate_potential.mod cp_external_control.mod qs_vxc_atom.mod kinds.mod xtb_ehess.mod hartree_local_methods.mod cp_output_handling.mod qs_rho_methods.mod qs_collocate_density.mod qs_ks_atom.mod base_hooks.mod string_utilities.mod kg_correction.mod qs_loc_methods.mod machine.mod cp_fm_basic_linalg.mod xc.mod qs_gapw_densities.mod cp_files.mod cp_gemm_interface.mod cp_log_handling.mod lri_ks_methods.mod qs_rho0_ggrid.mod message_passing.mod xc_derivatives.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_linres_polar_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_polar_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_p_env_types.mod cell_types.mod cp_fm_types.mod force_env_types.mod cp_control_types.mod cp_result_types.mod qs_linres_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod cp_fm_struct.mod qs_matrix_pools.mod qs_linres_methods.mod kinds.mod bibliography.mod cp_output_handling.mod base_hooks.mod mathconstants.mod physcon.mod machine.mod cp_fm_basic_linalg.mod cp_log_handling.mod cp_result_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_polar_utils.F qs_linres_polar_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:04:38 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_polar_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_polar_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_linres_polar_utils.mod' due to: qs_linres_polar_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_polar_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_p_env_types.mod cell_types.mod cp_fm_types.mod force_env_types.mod cp_control_types.mod cp_result_types.mod qs_linres_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod cp_fm_struct.mod qs_matrix_pools.mod qs_linres_methods.mod kinds.mod bibliography.mod cp_output_handling.mod base_hooks.mod mathconstants.mod physcon.mod machine.mod cp_fm_basic_linalg.mod cp_log_handling.mod cp_result_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'md_energies.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_energies.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod reftraj_types.mod atomic_kind_types.mod md_environment_types.mod cell_types.mod force_env_types.mod thermal_region_types.mod barostat_types.mod atomic_kind_list_types.mod virial_types.mod averages_types.mod input_enumeration_types.mod input_section_types.mod simpar_types.mod cp_subsys_types.mod cp_para_types.mod input_keyword_types.mod thermostat_types.mod md_ener_types.mod particle_list_types.mod input_constants.mod particle_methods.mod thermostat_utils.mod kinds.mod input_cp2k_md.mod cp_output_handling.mod md_conserved_quantities.mod base_hooks.mod physcon.mod machine.mod cp_units.mod thermal_region_utils.mod cp_log_handling.mod qs_linres_polar_utils.mod motion_utils.mod barostat_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_energies.F md_energies.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:04:42 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/md_energies.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' md_energies.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_energies.F:362:46: 362 | (simpar%v0 - cell%deth) | ^ Warning: ‘pv_xx_nc’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'md_energies.mod' due to: md_energies.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_energies.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod reftraj_types.mod atomic_kind_types.mod md_environment_types.mod cell_types.mod force_env_types.mod thermal_region_types.mod barostat_types.mod atomic_kind_list_types.mod virial_types.mod averages_types.mod input_enumeration_types.mod input_section_types.mod simpar_types.mod cp_subsys_types.mod cp_para_types.mod input_keyword_types.mod thermostat_types.mod md_ener_types.mod particle_list_types.mod input_constants.mod particle_methods.mod thermostat_utils.mod kinds.mod input_cp2k_md.mod cp_output_handling.mod md_conserved_quantities.mod base_hooks.mod physcon.mod machine.mod cp_units.mod thermal_region_utils.mod cp_log_handling.mod qs_linres_polar_utils.mod motion_utils.mod barostat_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'moments_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/moments_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod fist_environment_types.mod distribution_1d_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod base_hooks.mod kinds.mod input_constants.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/moments_utils.F moments_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:04:48 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"moments_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' moments_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'moments_utils.mod' due to: moments_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/moments_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod fist_environment_types.mod distribution_1d_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod base_hooks.mod kinds.mod input_constants.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ai_angmom.mod' due to: ai_angmom.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_operators_ao.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_operators_ao.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod qs_environment_types.mod block_p_types.mod qs_neighbor_list_types.mod particle_types.mod qs_kind_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod ai_moments.mod ai_os_rr.mod mathconstants.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_operators_ao.F qs_operators_ao.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:04:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_operators_ao.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_operators_ao.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_operators_ao.F:1477:13: 1477 | IF (jatom /= last_jatom) THEN | ^ Warning: ‘last_jatom’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_operators_ao.F:1472:63: 1472 | IF (ABS(rab(1)) > Lxo2 .OR. ABS(rab(2)) > Lyo2 .OR. ABS(rab(3)) > Lzo2) CYCLE | ^ Warning: ‘lzo2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_operators_ao.F:1472:63: Warning: ‘lyo2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_operators_ao.F:1472:63: Warning: ‘lxo2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_operators_ao.F:1195:13: 1195 | IF (jatom /= last_jatom) THEN | ^ Warning: ‘last_jatom’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_operators_ao.F:1190:63: 1190 | IF (ABS(rab(1)) > Lxo2 .OR. ABS(rab(2)) > Lyo2 .OR. ABS(rab(3)) > Lzo2) CYCLE | ^ Warning: ‘lzo2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_operators_ao.F:1190:63: Warning: ‘lyo2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_operators_ao.F:1190:63: Warning: ‘lxo2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_operators_ao.F:919:13: 919 | IF (jatom /= last_jatom) THEN | ^ Warning: ‘last_jatom’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_operators_ao.F:916:63: 916 | IF (ABS(rab(1)) > Lxo2 .OR. ABS(rab(2)) > Lyo2 .OR. ABS(rab(3)) > Lzo2) CYCLE | ^ Warning: ‘lzo2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_operators_ao.F:916:63: Warning: ‘lyo2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_operators_ao.F:916:63: Warning: ‘lxo2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_operators_ao.F:534:13: 534 | IF (jatom /= last_jatom) THEN | ^ Warning: ‘last_jatom’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_operators_ao.F:180:13: 180 | IF (jatom /= last_jatom) THEN | ^ Warning: ‘last_jatom’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_operators_ao.mod' due to: qs_operators_ao.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_operators_ao.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod qs_environment_types.mod block_p_types.mod qs_neighbor_list_types.mod particle_types.mod qs_kind_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod ai_moments.mod ai_os_rr.mod mathconstants.mod orbital_pointers.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'commutator_rpnl.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod sap_kind_types.mod block_p_types.mod qs_neighbor_list_types.mod external_potential_types.mod particle_types.mod qs_kind_types.mod cell_types.mod base_hooks.mod kinds.mod ai_moments.mod orbital_pointers.mod ai_overlap.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F commutator_rpnl.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:04:57 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"commutator_rpnl.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' commutator_rpnl.F90 /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:645:72: 645 | !$ hash = MOD((iatom - 1)*natom + jatom, nlock) + 1 | ^ Warning: ‘natom’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:443:81: 443 | kbc, kkind, na, natom, nb, nkind, np, & | ^ note: ‘natom’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:276:91: 276 | cprj(1, prjc), SIZE(cprj, 1), 0.0_dp, work(1, 1, i), ldsab) | ^ Warning: ‘cprj.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:98:64: 98 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: cprj, rpgfa, sphi_a, vprj_ppnl, x_block, & | ^ note: ‘cprj.dim[1].stride’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:276:91: 276 | cprj(1, prjc), SIZE(cprj, 1), 0.0_dp, work(1, 1, i), ldsab) | ^ Warning: ‘cprj.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:98:64: 98 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: cprj, rpgfa, sphi_a, vprj_ppnl, x_block, & | ^ note: ‘cprj.dim[0].ubound’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:276:91: 276 | cprj(1, prjc), SIZE(cprj, 1), 0.0_dp, work(1, 1, i), ldsab) | ^ Warning: ‘cprj.dim[0].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:98:64: 98 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: cprj, rpgfa, sphi_a, vprj_ppnl, x_block, & | ^ note: ‘cprj.dim[0].lbound’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:276:91: 276 | cprj(1, prjc), SIZE(cprj, 1), 0.0_dp, work(1, 1, i), ldsab) | ^ Warning: ‘cprj.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:98:64: 98 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: cprj, rpgfa, sphi_a, vprj_ppnl, x_block, & | ^ note: ‘cprj.dim[0].stride’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:276:91: 276 | cprj(1, prjc), SIZE(cprj, 1), 0.0_dp, work(1, 1, i), ldsab) | ^ Warning: ‘cprj.span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:98:64: 98 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: cprj, rpgfa, sphi_a, vprj_ppnl, x_block, & | ^ note: ‘cprj.span’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:276:91: 276 | cprj(1, prjc), SIZE(cprj, 1), 0.0_dp, work(1, 1, i), ldsab) | ^ Warning: ‘cprj.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:98:64: 98 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: cprj, rpgfa, sphi_a, vprj_ppnl, x_block, & | ^ note: ‘cprj.offset’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:276:91: 276 | cprj(1, prjc), SIZE(cprj, 1), 0.0_dp, work(1, 1, i), ldsab) | ^ Warning: ‘cprj.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:98:64: 98 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: cprj, rpgfa, sphi_a, vprj_ppnl, x_block, & | ^ note: ‘cprj.data’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:97:70: 97 | REAL(KIND=dp), DIMENSION(:), POINTER :: alpha_ppnl, set_radius_a | ^ Warning: ‘alpha_ppnl.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:97:70: Warning: ‘alpha_ppnl.span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:97:70: Warning: ‘alpha_ppnl.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:97:70: Warning: ‘alpha_ppnl.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:89:92: 89 | INTEGER, DIMENSION(:), POINTER :: la_max, la_min, npgfa, nprj_ppnl, & | ^ Warning: ‘nprj_ppnl.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:89:92: Warning: ‘nprj_ppnl.span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:89:92: Warning: ‘nprj_ppnl.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:89:92: Warning: ‘nprj_ppnl.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:98:90: 98 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: cprj, rpgfa, sphi_a, vprj_ppnl, x_block, & | ^ Warning: ‘vprj_ppnl.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:286:106: 286 | vprj_ppnl(1, 1), SIZE(vprj_ppnl, 1), 0.0_dp, clist%achint(sgfa, 1, i), nsgfa) | ^ Warning: ‘vprj_ppnl.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:98:90: 98 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: cprj, rpgfa, sphi_a, vprj_ppnl, x_block, & | ^ note: ‘vprj_ppnl.dim[0].ubound’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:286:106: 286 | vprj_ppnl(1, 1), SIZE(vprj_ppnl, 1), 0.0_dp, clist%achint(sgfa, 1, i), nsgfa) | ^ Warning: ‘vprj_ppnl.dim[0].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:98:90: 98 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: cprj, rpgfa, sphi_a, vprj_ppnl, x_block, & | ^ note: ‘vprj_ppnl.dim[0].lbound’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:98:90: Warning: ‘vprj_ppnl.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:98:90: Warning: ‘vprj_ppnl.span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:98:90: Warning: ‘vprj_ppnl.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:286:106: 286 | vprj_ppnl(1, 1), SIZE(vprj_ppnl, 1), 0.0_dp, clist%achint(sgfa, 1, i), nsgfa) | ^ Warning: ‘vprj_ppnl.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:98:90: 98 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: cprj, rpgfa, sphi_a, vprj_ppnl, x_block, & | ^ note: ‘vprj_ppnl.data’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:263:22: 263 | IF (set_radius_a(iset) + rprjc(1) < dac) CYCLE | ^ Warning: ‘ppnl_radius’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F:93:76: 93 | REAL(KIND=dp) :: dac, ppnl_radius | ^ note: ‘ppnl_radius’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'commutator_rpnl.mod' due to: commutator_rpnl.o /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rpnl.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod sap_kind_types.mod block_p_types.mod qs_neighbor_list_types.mod external_potential_types.mod particle_types.mod qs_kind_types.mod cell_types.mod base_hooks.mod kinds.mod ai_moments.mod orbital_pointers.mod ai_overlap.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_moments.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_moments.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod block_p_types.mod cp_control_types.mod cp_result_types.mod kpoint_types.mod qs_rho_types.mod particle_types.mod rt_propagation_types.mod cp_cfm_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod distribution_1d_types.mod moments_utils.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod particle_methods.mod kinds.mod ai_moments.mod cp_cfm_basic_linalg.mod base_hooks.mod ai_angmom.mod qs_operators_ao.mod mathconstants.mod physcon.mod commutator_rpnl.mod cp_gemm_interface.mod orbital_pointers.mod message_passing.mod cp_dbcsr_operations.mod cp_result_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_moments.F qs_moments.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:05:32 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_moments.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_moments.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_moments.F:493:13: 493 | IF (jatom == last_jatom) THEN | ^ Warning: ‘last_jatom’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_moments.F:232:13: 232 | IF (jatom == last_jatom) THEN | ^ Warning: ‘last_jatom’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_moments.F:755:13: 755 | IF (jatom == last_jatom) THEN | ^ Warning: ‘last_jatom’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_moments.F:643:97: 643 | INTEGER :: handle, i, iatom, icol, ikind, inode, irow, iset, jatom, jkind, jset, last_jatom, & | ^ note: ‘last_jatom’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/qs_moments.F:2085:10: 2085 | IF (my_com_nl) THEN | ^ Warning: ‘my_com_nl’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_moments.mod' due to: qs_moments.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_moments.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod block_p_types.mod cp_control_types.mod cp_result_types.mod kpoint_types.mod qs_rho_types.mod particle_types.mod rt_propagation_types.mod cp_cfm_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod distribution_1d_types.mod moments_utils.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod particle_methods.mod kinds.mod ai_moments.mod cp_cfm_basic_linalg.mod base_hooks.mod ai_angmom.mod qs_operators_ao.mod mathconstants.mod physcon.mod commutator_rpnl.mod cp_gemm_interface.mod orbital_pointers.mod message_passing.mod cp_dbcsr_operations.mod cp_result_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rt_delta_pulse.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_delta_pulse.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod particle_types.mod cp_cfm_types.mod qs_mo_types.mod rt_propagation_types.mod input_section_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod qs_moments.mod cp_fm_diag.mod kinds.mod cp_cfm_basic_linalg.mod base_hooks.mod cp_cfm_diag.mod mathconstants.mod commutator_rpnl.mod cp_fm_basic_linalg.mod cp_fm_cholesky.mod cp_gemm_interface.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_delta_pulse.F rt_delta_pulse.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:05:45 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"emd/rt_delta_pulse.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/emd/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_delta_pulse.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rt_delta_pulse.mod' due to: rt_delta_pulse.o /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_delta_pulse.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod particle_types.mod cp_cfm_types.mod qs_mo_types.mod rt_propagation_types.mod input_section_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod qs_moments.mod cp_fm_diag.mod kinds.mod cp_cfm_basic_linalg.mod base_hooks.mod cp_cfm_diag.mod mathconstants.mod commutator_rpnl.mod cp_fm_basic_linalg.mod cp_fm_cholesky.mod cp_gemm_interface.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_mo_io.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_io.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cp_fm_types.mod basis_set_types.mod particle_types.mod qs_dftb_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod string_utilities.mod qs_mo_methods.mod qs_mo_occupation.mod kinds.mod qs_dftb_utils.mod cp_output_handling.mod base_hooks.mod orbital_symbols.mod physcon.mod cp_files.mod cp_log_handling.mod kahan_sum.mod orbital_transformation_matrices.mod orbital_pointers.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_io.F qs_mo_io.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:05:49 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_mo_io.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_mo_io.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_io.F:679:32: 679 | nspin_read, offset_read, source | ^ Warning: ‘offset_read’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_io.F:871:31: 871 | IF (minbas) THEN | ^ Warning: ‘minbas’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_io.F:922:48: 922 | READ (rst_unit) vecbuffer_read | ^ Warning: ‘vecbuffer_read.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_io.F:685:85: 685 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: vecbuffer, vecbuffer_read | ^ Warning: ‘vecbuffer_read.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_io.F:682:81: 682 | INTEGER, DIMENSION(:, :, :), POINTER :: nso_info, offset_info | ^ Warning: ‘offset_info.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_io.F:879:89: 879 | offset_read = offset_info(ishell_read, iset_read, iatom) | ^ Warning: ‘offset_info.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_io.F:682:81: 682 | INTEGER, DIMENSION(:, :, :), POINTER :: nso_info, offset_info | ^ Warning: ‘offset_info.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_io.F:953:33: 953 | DEALLOCATE (offset_info) | ^ Warning: ‘offset_info.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_io.F:682:68: 682 | INTEGER, DIMENSION(:, :, :), POINTER :: nso_info, offset_info | ^ Warning: ‘nso_info.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_io.F:878:34: 878 | IF (nso(lshell) == nso_info(ishell_read, iset_read, iatom)) THEN | ^ Warning: ‘nso_info.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_io.F:682:68: 682 | INTEGER, DIMENSION(:, :, :), POINTER :: nso_info, offset_info | ^ Warning: ‘nso_info.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_io.F:878:34: 878 | IF (nso(lshell) == nso_info(ishell_read, iset_read, iatom)) THEN | ^ Warning: ‘nso_info.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_io.F:681:74: 681 | INTEGER, DIMENSION(:, :), POINTER :: l, nshell_info | ^ Warning: ‘nshell_info.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_io.F:681:74: Warning: ‘nshell_info.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_io.F:681:74: Warning: ‘nshell_info.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_io.F:680:69: 680 | INTEGER, DIMENSION(:), POINTER :: nset_info, nshell | ^ Warning: ‘nset_info.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_io.F:1013:67: 1013 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: cmatrix, smatrix | ^ Warning: ‘cmatrix.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_io.F:1013:67: Warning: ‘cmatrix.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_mo_io.mod' due to: qs_mo_io.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_mo_io.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cp_fm_types.mod basis_set_types.mod particle_types.mod qs_dftb_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod string_utilities.mod qs_mo_methods.mod qs_mo_occupation.mod kinds.mod qs_dftb_utils.mod cp_output_handling.mod base_hooks.mod orbital_symbols.mod physcon.mod cp_files.mod cp_log_handling.mod kahan_sum.mod orbital_transformation_matrices.mod orbital_pointers.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_dftb_coulomb.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_coulomb.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 sap_kind_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod kpoint_types.mod atprop_types.mod qs_rho_types.mod particle_types.mod qs_dftb_types.mod ewald_environment_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_poisson_types.mod distribution_1d_types.mod ewald_pw_types.mod qmmm_tb_coulomb.mod kinds.mod qs_dftb_utils.mod base_hooks.mod mathconstants.mod ewald_methods_tb.mod qs_dftb3_methods.mod message_passing.mod virial_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_coulomb.F qs_dftb_coulomb.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:05:53 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dftb_coulomb.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dftb_coulomb.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_dftb_coulomb.mod' due to: qs_dftb_coulomb.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_coulomb.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 sap_kind_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod kpoint_types.mod atprop_types.mod qs_rho_types.mod particle_types.mod qs_dftb_types.mod ewald_environment_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_poisson_types.mod distribution_1d_types.mod ewald_pw_types.mod qmmm_tb_coulomb.mod kinds.mod qs_dftb_utils.mod base_hooks.mod mathconstants.mod ewald_methods_tb.mod qs_dftb3_methods.mod message_passing.mod virial_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_dbcsr_output.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/cp_dbcsr_output.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod qs_environment_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod machine.mod orbital_pointers.mod message_passing.mod particle_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/cp_dbcsr_output.F cp_dbcsr_output.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:06:00 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_dbcsr_output.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_dbcsr_output.F90 /build/cp2k-Q381vr/cp2k-8.1/src/cp_dbcsr_output.F:245:10: 245 | IF (print_sym) THEN | ^ Warning: ‘print_sym’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_dbcsr_output.mod' due to: cp_dbcsr_output.o /build/cp2k-Q381vr/cp2k-8.1/src/cp_dbcsr_output.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod qs_environment_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod machine.mod orbital_pointers.mod message_passing.mod particle_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'efield_tb_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/efield_tb_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod kpoint_types.mod qs_rho_types.mod qs_period_efield_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod kinds.mod base_hooks.mod mathconstants.mod message_passing.mod virial_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/efield_tb_methods.F efield_tb_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:06:04 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"efield_tb_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' efield_tb_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'efield_tb_methods.mod' due to: efield_tb_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/efield_tb_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod kpoint_types.mod qs_rho_types.mod qs_period_efield_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod kinds.mod base_hooks.mod mathconstants.mod message_passing.mod virial_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_dftb_matrices.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_matrices.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod qs_force_types.mod block_p_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod kpoint_types.mod atprop_types.mod qs_rho_types.mod particle_types.mod qs_dftb_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_dftb_coulomb.mod cp_dbcsr_cp2k_link.mod cp_dbcsr_output.mod mulliken.mod particle_methods.mod kinds.mod qs_dftb_utils.mod efield_tb_methods.mod cp_output_handling.mod base_hooks.mod cp_log_handling.mod message_passing.mod virial_methods.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_matrices.F qs_dftb_matrices.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:06:10 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dftb_matrices.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dftb_matrices.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_matrices.F:419:19: 419 | IF (use_virial) THEN | ^ Warning: ‘use_virial’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_dftb_matrices.mod' due to: qs_dftb_matrices.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_matrices.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod qs_force_types.mod block_p_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod kpoint_types.mod atprop_types.mod qs_rho_types.mod particle_types.mod qs_dftb_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_dftb_coulomb.mod cp_dbcsr_cp2k_link.mod cp_dbcsr_output.mod mulliken.mod particle_methods.mod kinds.mod qs_dftb_utils.mod efield_tb_methods.mod cp_output_handling.mod base_hooks.mod cp_log_handling.mod message_passing.mod virial_methods.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rt_propagation_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_propagation_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod qs_kind_types.mod atomic_kind_types.mod cp_fm_types.mod cp_control_types.mod qs_rho_types.mod particle_types.mod rt_propagation_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_mo_methods.mod input_constants.mod cp_fm_vect.mod qs_mo_io.mod kinds.mod qs_rho_methods.mod base_hooks.mod mathconstants.mod qs_overlap.mod cp_fm_basic_linalg.mod qs_dftb_matrices.mod cp_log_handling.mod orbital_pointers.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_propagation_utils.F rt_propagation_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:06:18 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"emd/rt_propagation_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/emd/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_propagation_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rt_propagation_utils.mod' due to: rt_propagation_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_propagation_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod qs_kind_types.mod atomic_kind_types.mod cp_fm_types.mod cp_control_types.mod qs_rho_types.mod particle_types.mod rt_propagation_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_mo_methods.mod input_constants.mod cp_fm_vect.mod qs_mo_io.mod kinds.mod qs_rho_methods.mod base_hooks.mod mathconstants.mod qs_overlap.mod cp_fm_basic_linalg.mod qs_dftb_matrices.mod cp_log_handling.mod orbital_pointers.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ls_matrix_exp.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/ls_matrix_exp.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_log_handling.mod kinds.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/ls_matrix_exp.F ls_matrix_exp.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:06:22 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ls_matrix_exp.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ls_matrix_exp.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ls_matrix_exp.mod' due to: ls_matrix_exp.o /build/cp2k-Q381vr/cp2k-8.1/src/ls_matrix_exp.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_log_handling.mod kinds.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rt_make_propagators.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_make_propagators.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod rt_propagation_types.mod cp_fm_types.mod base_hooks.mod ls_matrix_exp.mod kinds.mod matrix_exp.mod input_constants.mod cp_fm_vect.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_make_propagators.F rt_make_propagators.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:06:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"emd/rt_make_propagators.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/emd/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_make_propagators.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rt_make_propagators.mod' due to: rt_make_propagators.o /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_make_propagators.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod rt_propagation_types.mod cp_fm_types.mod base_hooks.mod ls_matrix_exp.mod kinds.mod matrix_exp.mod input_constants.mod cp_fm_vect.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'spglib_f08.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/spglib_f08.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/spglib_f08.F spglib_f08.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:06:25 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"spglib_f08.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' spglib_f08.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'spglib_f08.mod' due to: spglib_f08.o /build/cp2k-Q381vr/cp2k-8.1/src/spglib_f08.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cryssym.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/cryssym.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod spglib_f08.mod bibliography.mod string_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/cryssym.F cryssym.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:06:25 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cryssym.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cryssym.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cryssym.mod' due to: cryssym.o /build/cp2k-Q381vr/cp2k-8.1/src/cryssym.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod spglib_f08.mod bibliography.mod string_utilities.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'kpoint_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod kpoint_types.mod cp_fm_pool_types.mod particle_types.mod qs_mo_types.mod scf_control_types.mod cp_para_types.mod qs_neighbor_list_types.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod qs_matrix_pools.mod input_constants.mod kinds.mod cp_blacs_env.mod cp_para_env.mod base_hooks.mod util.mod mathconstants.mod cp_fm_basic_linalg.mod cryssym.mod cp_gemm_interface.mod cp_log_handling.mod memory_utilities.mod message_passing.mod cp_dbcsr_operations.mod fermi_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_methods.F kpoint_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:06:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kpoint_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kpoint_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_methods.F:342:26: 342 | nkp_grp = npe/ngr | ^ Warning: ‘ngr’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'kpoint_methods.mod' due to: kpoint_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod kpoint_types.mod cp_fm_pool_types.mod particle_types.mod qs_mo_types.mod scf_control_types.mod cp_para_types.mod qs_neighbor_list_types.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod qs_matrix_pools.mod input_constants.mod kinds.mod cp_blacs_env.mod cp_para_env.mod base_hooks.mod util.mod mathconstants.mod cp_fm_basic_linalg.mod cryssym.mod cp_gemm_interface.mod cp_log_handling.mod memory_utilities.mod message_passing.mod cp_dbcsr_operations.mod fermi_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mao_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mao_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cp_fm_types.mod basis_set_types.mod basis_set_container_types.mod cp_control_types.mod kpoint_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod lapack.mod kpoint_methods.mod cp_fm_diag.mod input_constants.mod kinds.mod base_hooks.mod qs_interactions.mod iterate_matrix.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mao_methods.F mao_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:06:33 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mao_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mao_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mao_methods.mod' due to: mao_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/mao_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cp_fm_types.mod basis_set_types.mod basis_set_container_types.mod cp_control_types.mod kpoint_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod lapack.mod kpoint_methods.mod cp_fm_diag.mod input_constants.mod kinds.mod base_hooks.mod qs_interactions.mod iterate_matrix.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'subcell_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/subcell_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cell_types.mod base_hooks.mod kinds.mod util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/subcell_types.F subcell_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:06:39 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subcell_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' subcell_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'subcell_types.mod' due to: subcell_types.o /build/cp2k-Q381vr/cp2k-8.1/src/subcell_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cell_types.mod base_hooks.mod kinds.mod util.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_neighbor_lists.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_neighbor_lists.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 almo_scf_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod cp_control_types.mod distribution_2d_types.mod kpoint_types.mod particle_types.mod paw_proj_set_types.mod qs_dftb_types.mod qs_gcp_types.mod molecule_types.mod qs_dispersion_types.mod input_section_types.mod ewald_environment_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod distribution_1d_types.mod external_potential_types.mod subcell_types.mod string_utilities.mod input_constants.mod kinds.mod qs_dftb_utils.mod cp_output_handling.mod periodic_table.mod base_hooks.mod util.mod physcon.mod cp_units.mod cp_log_handling.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_neighbor_lists.F qs_neighbor_lists.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:06:40 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_neighbor_lists.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_neighbor_lists.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_neighbor_lists.F:1326:43: 1326 | IF (mol_a /= mol_b) CYCLE | ^ Warning: ‘mol_b’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_neighbor_lists.F:1158:53: 1158 | CPABORT("") | ^ Warning: ‘otype’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_neighbor_lists.mod' due to: qs_neighbor_lists.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_neighbor_lists.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 almo_scf_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod cp_control_types.mod distribution_2d_types.mod kpoint_types.mod particle_types.mod paw_proj_set_types.mod qs_dftb_types.mod qs_gcp_types.mod molecule_types.mod qs_dispersion_types.mod input_section_types.mod ewald_environment_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod distribution_1d_types.mod external_potential_types.mod subcell_types.mod string_utilities.mod input_constants.mod kinds.mod qs_dftb_utils.mod cp_output_handling.mod periodic_table.mod base_hooks.mod util.mod physcon.mod cp_units.mod cp_log_handling.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mao_optimizer.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mao_optimizer.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod mao_methods.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mao_optimizer.F mao_optimizer.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:06:48 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mao_optimizer.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mao_optimizer.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mao_optimizer.mod' due to: mao_optimizer.o /build/cp2k-Q381vr/cp2k-8.1/src/mao_optimizer.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod mao_methods.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mao_basis.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mao_basis.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_environment_types.mod qs_rho_types.mod cp_control_types.mod qs_neighbor_list_types.mod particle_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod base_hooks.mod kinds.mod mao_methods.mod qs_overlap.mod cp_dbcsr_operations.mod qs_neighbor_lists.mod particle_methods.mod mao_optimizer.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mao_basis.F mao_basis.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:06:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mao_basis.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mao_basis.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mao_basis.mod' due to: mao_basis.o /build/cp2k-Q381vr/cp2k-8.1/src/mao_basis.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_environment_types.mod qs_rho_types.mod cp_control_types.mod qs_neighbor_list_types.mod particle_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod base_hooks.mod kinds.mod mao_methods.mod qs_overlap.mod cp_dbcsr_operations.mod qs_neighbor_lists.mod particle_methods.mod mao_optimizer.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'minbas_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/minbas_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod cp_fm_types.mod cp_control_types.mod particle_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod cp_fm_struct.mod lapack.mod cp_fm_diag.mod particle_methods.mod kinds.mod cp_blacs_env.mod base_hooks.mod mao_basis.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/minbas_methods.F minbas_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:06:53 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"minbas_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' minbas_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'minbas_methods.mod' due to: minbas_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/minbas_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod cp_fm_types.mod cp_control_types.mod particle_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod cp_fm_struct.mod lapack.mod cp_fm_diag.mod particle_methods.mod kinds.mod cp_blacs_env.mod base_hooks.mod mao_basis.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'molden_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/molden_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod qs_mo_types.mod input_section_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathconstants.mod orbital_transformation_matrices.mod cp_output_handling.mod orbital_pointers.mod input_constants.mod periodic_table.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/molden_utils.F molden_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:06:57 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"molden_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molden_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/src/molden_utils.F:81:67: 81 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :) :: cmatrix, smatrix | ^ Warning: ‘cmatrix.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'molden_utils.mod' due to: molden_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/molden_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod qs_mo_types.mod input_section_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathconstants.mod orbital_transformation_matrices.mod cp_output_handling.mod orbital_pointers.mod input_constants.mod periodic_table.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'minbas_wfn_analysis.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/minbas_wfn_analysis.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod qs_subsys_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod particle_list_types.mod minbas_methods.mod cp_fm_struct.mod mulliken.mod qs_mo_methods.mod particle_methods.mod molden_utils.mod cp_realspace_grid_cube.mod kinds.mod atomic_charges.mod cp_blacs_env.mod bibliography.mod cp_output_handling.mod qs_collocate_density.mod base_hooks.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_log_handling.mod iterate_matrix.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/minbas_wfn_analysis.F minbas_wfn_analysis.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:06:59 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"minbas_wfn_analysis.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' minbas_wfn_analysis.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'minbas_wfn_analysis.mod' due to: minbas_wfn_analysis.o /build/cp2k-Q381vr/cp2k-8.1/src/minbas_wfn_analysis.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod qs_subsys_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod particle_list_types.mod minbas_methods.mod cp_fm_struct.mod mulliken.mod qs_mo_methods.mod particle_methods.mod molden_utils.mod cp_realspace_grid_cube.mod kinds.mod atomic_charges.mod cp_blacs_env.mod bibliography.mod cp_output_handling.mod qs_collocate_density.mod base_hooks.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_log_handling.mod iterate_matrix.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_chargemol.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_chargemol.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod qs_force_types.mod cp_control_types.mod qs_energy_types.mod qs_subsys_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod qs_environment_types.mod kinds.mod cp_output_handling.mod periodic_table.mod base_hooks.mod orbital_symbols.mod machine.mod cp_files.mod cp_log_handling.mod orbital_transformation_matrices.mod orbital_pointers.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_chargemol.F qs_chargemol.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:07:05 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_chargemol.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_chargemol.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_chargemol.F:163:83: 163 | extension=".wfx", my_local=.FALSE.) | 1 Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/qs_chargemol.F:487:78: 487 | pgf_type_chargemol(bcgf_symbol(icgf) (3:)) | ^ Warning: ‘label’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_chargemol.F:480:78: 480 | pgf_type_chargemol(bcgf_symbol(icgf) (3:)) | ^ Warning: ‘label’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_chargemol.F:755:22: 755 | IF (newl) THEN | ^ Warning: ‘newl’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_chargemol.F:576:49: 576 | DO imo = 1, mos(roks_low)%mo_set%homo | ^ Warning: ‘roks_low’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_chargemol.F:581:78: 581 | DO imo = mos(roks_low)%mo_set%homo + 1, mos(roks_high)%mo_set%homo | ^ Warning: ‘roks_high’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_chargemol.mod' due to: qs_chargemol.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_chargemol.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod qs_force_types.mod cp_control_types.mod qs_energy_types.mod qs_subsys_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod qs_environment_types.mod kinds.mod cp_output_handling.mod periodic_table.mod base_hooks.mod orbital_symbols.mod machine.mod cp_files.mod cp_log_handling.mod orbital_transformation_matrices.mod orbital_pointers.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 's_square_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/s_square_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_control_types.mod qs_mo_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_fm_struct.mod cp_blacs_env.mod message_passing.mod input_constants.mod cp_dbcsr_operations.mod cp_gemm_interface.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/s_square_methods.F s_square_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:07:11 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"s_square_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' s_square_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 's_square_methods.mod' due to: s_square_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/s_square_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_control_types.mod qs_mo_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_fm_struct.mod cp_blacs_env.mod message_passing.mod input_constants.mod cp_dbcsr_operations.mod cp_gemm_interface.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'stm_images.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/stm_images.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod pw_types.mod cp_fm_types.mod qs_rho_types.mod qs_mo_types.mod input_section_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod particle_list_types.mod cp_fm_struct.mod cp_array_utils.mod cp_realspace_grid_cube.mod kinds.mod cp_output_handling.mod qs_collocate_density.mod base_hooks.mod cp_fm_basic_linalg.mod cp_log_handling.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/stm_images.F stm_images.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:07:11 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"stm_images.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' stm_images.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'stm_images.mod' due to: stm_images.o /build/cp2k-Q381vr/cp2k-8.1/src/stm_images.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod pw_types.mod cp_fm_types.mod qs_rho_types.mod qs_mo_types.mod input_section_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod particle_list_types.mod cp_fm_struct.mod cp_array_utils.mod cp_realspace_grid_cube.mod kinds.mod cp_output_handling.mod qs_collocate_density.mod base_hooks.mod cp_fm_basic_linalg.mod cp_log_handling.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_dbcsr_cholesky.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/cp_dbcsr_cholesky.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_fm_struct.mod cp_blacs_env.mod cp_fm_basic_linalg.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/cp_dbcsr_cholesky.F cp_dbcsr_cholesky.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:07:14 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_dbcsr_cholesky.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_dbcsr_cholesky.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_dbcsr_cholesky.mod' due to: cp_dbcsr_cholesky.o /build/cp2k-Q381vr/cp2k-8.1/src/cp_dbcsr_cholesky.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_fm_struct.mod cp_blacs_env.mod cp_fm_basic_linalg.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mao_wfn_analysis.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mao_wfn_analysis.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod basis_set_types.mod cp_control_types.mod kpoint_types.mod qs_rho_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod mathlib.mod cp_dbcsr_cp2k_link.mod mao_methods.mod particle_methods.mod kinds.mod cp_blacs_env.mod bibliography.mod base_hooks.mod qs_overlap.mod mao_optimizer.mod iterate_matrix.mod message_passing.mod cp_dbcsr_cholesky.mod cp_dbcsr_operations.mod qs_neighbor_lists.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mao_wfn_analysis.F mao_wfn_analysis.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:07:15 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mao_wfn_analysis.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mao_wfn_analysis.F90 /build/cp2k-Q381vr/cp2k-8.1/src/mao_wfn_analysis.F:106:85: 106 | qmatbc, raq, sab, selnABC, sinv, & | ^ Warning: ‘selnabc.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mao_wfn_analysis.F:106:85: Warning: ‘selnabc.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mao_wfn_analysis.F:106:85: Warning: ‘selnabc.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mao_wfn_analysis.mod' due to: mao_wfn_analysis.o /build/cp2k-Q381vr/cp2k-8.1/src/mao_wfn_analysis.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod basis_set_types.mod cp_control_types.mod kpoint_types.mod qs_rho_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod mathlib.mod cp_dbcsr_cp2k_link.mod mao_methods.mod particle_methods.mod kinds.mod cp_blacs_env.mod bibliography.mod base_hooks.mod qs_overlap.mod mao_optimizer.mod iterate_matrix.mod message_passing.mod cp_dbcsr_cholesky.mod cp_dbcsr_operations.mod qs_neighbor_lists.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_ddapc_forces.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/cp_ddapc_forces.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod qs_environment_types.mod qs_force_types.mod cp_control_types.mod particle_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod base_hooks.mod kinds.mod mathconstants.mod spherical_harmonics.mod input_constants.mod message_passing.mod pw_spline_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/cp_ddapc_forces.F cp_ddapc_forces.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:07:33 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_ddapc_forces.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_ddapc_forces.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_ddapc_forces.mod' due to: cp_ddapc_forces.o /build/cp2k-Q381vr/cp2k-8.1/src/cp_ddapc_forces.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod qs_environment_types.mod qs_force_types.mod cp_control_types.mod particle_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod base_hooks.mod kinds.mod mathconstants.mod spherical_harmonics.mod input_constants.mod message_passing.mod pw_spline_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_ddapc_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/cp_ddapc_util.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod cell_types.mod pw_types.mod cp_control_types.mod qs_charges_types.mod cp_ddapc_types.mod qs_rho_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_methods.mod input_constants.mod kinds.mod atomic_charges.mod cp_ddapc_forces.mod cp_output_handling.mod cp_ddapc_methods.mod base_hooks.mod mathconstants.mod cp_log_handling.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/cp_ddapc_util.F cp_ddapc_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:07:37 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_ddapc_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_ddapc_util.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_ddapc_util.mod' due to: cp_ddapc_util.o /build/cp2k-Q381vr/cp2k-8.1/src/cp_ddapc_util.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod cell_types.mod pw_types.mod cp_control_types.mod qs_charges_types.mod cp_ddapc_types.mod qs_rho_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_methods.mod input_constants.mod kinds.mod atomic_charges.mod cp_ddapc_forces.mod cp_output_handling.mod cp_ddapc_methods.mod base_hooks.mod mathconstants.mod cp_log_handling.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'eigenvalueproblems.mod' due to: eigenvalueproblems.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'd3_poly.mod' due to: d3_poly.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_ks_qmmm_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_qmmm_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod pw_pool_types.mod qmmm_types_low.mod cp_control_types.mod pw_env_types.mod qs_ks_qmmm_types.mod input_section_types.mod pw_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cube_utils.mod cp_output_handling.mod pw_methods.mod input_constants.mod d3_poly.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_qmmm_methods.F qs_ks_qmmm_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:07:43 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ks_qmmm_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ks_qmmm_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_ks_qmmm_methods.mod' due to: qs_ks_qmmm_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_qmmm_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod pw_pool_types.mod qmmm_types_low.mod cp_control_types.mod pw_env_types.mod qs_ks_qmmm_types.mod input_section_types.mod pw_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cube_utils.mod cp_output_handling.mod pw_methods.mod input_constants.mod d3_poly.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fist_neighbor_lists.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fist_neighbor_lists.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod fist_neighbor_list_types.mod cell_types.mod exclusion_types.mod particle_types.mod input_section_types.mod cp_para_types.mod distribution_1d_types.mod subcell_types.mod mathlib.mod string_utilities.mod kinds.mod cp_output_handling.mod base_hooks.mod util.mod qmmm_ff_fist.mod cp_units.mod cp_log_handling.mod memory_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fist_neighbor_lists.F fist_neighbor_lists.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:07:45 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_neighbor_lists.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_neighbor_lists.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fist_neighbor_lists.mod' due to: fist_neighbor_lists.o /build/cp2k-Q381vr/cp2k-8.1/src/fist_neighbor_lists.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod fist_neighbor_list_types.mod cell_types.mod exclusion_types.mod particle_types.mod input_section_types.mod cp_para_types.mod distribution_1d_types.mod subcell_types.mod mathlib.mod string_utilities.mod kinds.mod cp_output_handling.mod base_hooks.mod util.mod qmmm_ff_fist.mod cp_units.mod cp_log_handling.mod memory_utilities.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fist_neighbor_list_control.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fist_neighbor_list_control.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 exclusion_types.mod fist_nonbond_env_types.mod cp_para_types.mod distribution_1d_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod fist_neighbor_list_types.mod pair_potential_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod fist_neighbor_lists.mod cp_output_handling.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fist_neighbor_list_control.F fist_neighbor_list_control.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:07:49 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_neighbor_list_control.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_neighbor_list_control.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fist_neighbor_list_control.mod' due to: fist_neighbor_list_control.o /build/cp2k-Q381vr/cp2k-8.1/src/fist_neighbor_list_control.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 exclusion_types.mod fist_nonbond_env_types.mod cp_para_types.mod distribution_1d_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod fist_neighbor_list_types.mod pair_potential_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod fist_neighbor_lists.mod cp_output_handling.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'semi_empirical_int3_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int3_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod base_hooks.mod kinds.mod input_constants.mod semi_empirical_int_arrays.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int3_utils.F semi_empirical_int3_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:07:51 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_int3_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_int3_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int3_utils.F:118:32: 118 | add = (pij + pkl)**2 | ^ Warning: ‘pkl’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int3_utils.F:118:32: Warning: ‘pij’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'semi_empirical_int3_utils.mod' due to: semi_empirical_int3_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int3_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod base_hooks.mod kinds.mod input_constants.mod semi_empirical_int_arrays.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'semi_empirical_int_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_debug.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod base_hooks.mod kinds.mod input_constants.mod semi_empirical_int3_utils.mod semi_empirical_int_arrays.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F semi_empirical_int_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:07:51 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_int_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_int_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:1214:38: 1214 | add = (pij + pkl)**2 | ^ Warning: ‘pkl’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:1214:38: Warning: ‘pij’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:314:38: 314 | add = (pij + pkl)**2 | ^ Warning: ‘pkl’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:314:38: Warning: ‘pij’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:841:24: 841 | fact = fact*0.5_dp | ^ Warning: ‘fact’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:875:37: 875 | IF (l1 == 0 .AND. l2 == 2 .AND. (m2 == CLMyy .OR. m2 == CLMxx)) THEN | ^ Warning: ‘m2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:940:37: 940 | IF (l1 == 2 .AND. l2 == 2 .AND. (((m1 == CLMyy) .AND. (m2 == CLMyy)) .OR. ((m1 == CLMxx) .AND. (m2 == CLMxx)))) THEN | ^ Warning: ‘m1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:843:23: 843 | IF (l1 == 0 .AND. l2 == 0) THEN | ^ Warning: ‘l2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:849:37: 849 | IF (l1 == 0 .AND. l2 == 1 .AND. m2 == CLMz) THEN | ^ Warning: ‘l1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:920:23: 920 | db = db/2.0_dp | ^ Warning: ‘db’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:923:109: 923 | + add0/SQRT((r - db)**2 + (da + db)**2 + add)**3 - add0/SQRT((r + db)**2 + (da + db)**2 + add)**3 | ^ Warning: ‘da’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:670:37: 670 | IF (l1 == 0 .AND. l2 == 2 .AND. (m2 == CLMyy .OR. m2 == CLMxx)) THEN | ^ Warning: ‘m2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:735:37: 735 | IF (l1 == 2 .AND. l2 == 2 .AND. (((m1 == CLMyy) .AND. (m2 == CLMyy)) .OR. ((m1 == CLMxx) .AND. (m2 == CLMxx)))) THEN | ^ Warning: ‘m1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:638:23: 638 | IF (l1 == 0 .AND. l2 == 0) THEN | ^ Warning: ‘l2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:644:37: 644 | IF (l1 == 0 .AND. l2 == 1 .AND. m2 == CLMz) THEN | ^ Warning: ‘l1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:640:28: 640 | charg = -charg*fact | ^ Warning: ‘fact’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:715:23: 715 | db = db/2.0_dp | ^ Warning: ‘db’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:718:117: 718 | + (r - db)/SQRT((r - db)**2 + (da + db)**2 + add)**3 - (r + db)/SQRT((r + db)**2 + (da + db)**2 + add)**3 | ^ Warning: ‘da’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:467:37: 467 | IF (l1 == 0 .AND. l2 == 2 .AND. (m2 == CLMyy .OR. m2 == CLMxx)) THEN | ^ Warning: ‘m2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:533:37: 533 | IF (l1 == 2 .AND. l2 == 2 .AND. (((m1 == CLMyy) .AND. (m2 == CLMyy)) .OR. ((m1 == CLMxx) .AND. (m2 == CLMxx)))) THEN | ^ Warning: ‘m1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:436:23: 436 | IF (l1 == 0 .AND. l2 == 0) THEN | ^ Warning: ‘l2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:441:37: 441 | IF (l1 == 0 .AND. l2 == 1 .AND. m2 == CLMz) THEN | ^ Warning: ‘l1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:443:34: 443 | charg = charg*0.5_dp*fact | ^ Warning: ‘fact’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:513:23: 513 | db = db/2.0_dp | ^ Warning: ‘db’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:516:107: 516 | + 1.0_dp/SQRT((r - db)**2 + (da + db)**2 + add) - 1.0_dp/SQRT((r + db)**2 + (da + db)**2 + add) | ^ Warning: ‘da’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:1958:60: 1958 | d_d(:, 1, 5) = pt5sq3*(s2a_d*sb2 + s2a*sb2_d) | ^ Warning: ‘sb2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:1959:60: 1959 | d_d(:, 2, 5) = 0.5_dp*(s2a_d*s2b + s2a*s2b_d) | ^ Warning: ‘s2b’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:1961:83: 1961 | d_d(:, 4, 5) = s2a_d*(cb2 + 0.5_dp*sb2) + s2a*(cb2_d + 0.5_dp*sb2_d) | ^ Warning: ‘s2a’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:1941:83: 1941 | d_d(:, 4, 1) = c2a_d*(cb2 + 0.5_dp*sb2) + c2a*(cb2_d + 0.5_dp*sb2_d) | ^ Warning: ‘cb2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:1954:49: 1954 | d_d(:, 2, 4) = sa_d*c2b + sa*c2b_d | ^ Warning: ‘c2b’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:1941:83: 1941 | d_d(:, 4, 1) = c2a_d*(cb2 + 0.5_dp*sb2) + c2a*(cb2_d + 0.5_dp*sb2_d) | ^ Warning: ‘c2a’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:1911:37: 1911 | r_d = (/x11, x22, x33/)/r | ^ Warning: ‘x33’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:1700:80: 1700 | sqb, sqb2i, x11, x22, x33 | ^ Warning: ‘x22’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:1700:75: 1700 | sqb, sqb2i, x11, x22, x33 | ^ Warning: ‘x11’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F:1919:42: 1919 | sb_d = (sqb_d*r - sqb*r_d)*r2i | ^ Warning: ‘sqb’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'semi_empirical_int_utils.mod' due to: semi_empirical_int_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_debug.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod base_hooks.mod kinds.mod input_constants.mod semi_empirical_int3_utils.mod semi_empirical_int_arrays.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'semi_empirical_int_num.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_num.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_args.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod taper_types.mod multipole_types.mod base_hooks.mod kinds.mod physcon.mod semi_empirical_int_utils.mod input_constants.mod semi_empirical_int_arrays.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_num.F semi_empirical_int_num.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:07:57 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_int_num.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_int_num.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'semi_empirical_int_num.mod' due to: semi_empirical_int_num.o /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_num.F /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_args.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod taper_types.mod multipole_types.mod base_hooks.mod kinds.mod physcon.mod semi_empirical_int_utils.mod input_constants.mod semi_empirical_int_arrays.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'semi_empirical_int_ana.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_ana.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_args.f90 /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_debug.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod taper_types.mod multipole_types.mod base_hooks.mod kinds.mod physcon.mod semi_empirical_int_num.mod semi_empirical_int_utils.mod input_constants.mod semi_empirical_int_arrays.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_ana.F semi_empirical_int_ana.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:07:59 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_int_ana.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_int_ana.F90 /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_ana.F:522:93: 522 | dscale = dscale + dzz*fnj1(ig)*EXP(-ax) - dax*zz*fnj1(ig)*EXP(-ax) | ^ Warning: ‘dzz’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_ana.F:422:73: 422 | dscale = SIGN(1.0_dp, scale*tmp)*(dscale*tmp + scale*dtmp) | ^ Warning: ‘dtmp’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_ana.F:216:57: 216 | tmp_d(3, m) = dcore(1, n)*drij(3) | ^ Warning: ‘drij[2]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_ana.F:215:57: 215 | tmp_d(2, m) = dcore(1, n)*drij(2) | ^ Warning: ‘drij[1]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_ana.F:214:57: 214 | tmp_d(1, m) = dcore(1, n)*drij(1) | ^ Warning: ‘drij[0]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'semi_empirical_int_ana.mod' due to: semi_empirical_int_ana.o /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_ana.F /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_args.f90 /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_debug.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod taper_types.mod multipole_types.mod base_hooks.mod kinds.mod physcon.mod semi_empirical_int_num.mod semi_empirical_int_utils.mod input_constants.mod semi_empirical_int_arrays.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'semi_empirical_int_gks.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_gks.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_mpole_types.mod dg_types.mod semi_empirical_types.mod pw_grid_types.mod dg_rho0_types.mod pw_pool_types.mod multipole_types.mod base_hooks.mod kinds.mod mathconstants.mod semi_empirical_int_arrays.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_gks.F semi_empirical_int_gks.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:08:04 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_int_gks.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_int_gks.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'semi_empirical_int_gks.mod' due to: semi_empirical_int_gks.o /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_gks.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_mpole_types.mod dg_types.mod semi_empirical_types.mod pw_grid_types.mod dg_rho0_types.mod pw_pool_types.mod multipole_types.mod base_hooks.mod kinds.mod mathconstants.mod semi_empirical_int_arrays.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'semi_empirical_integrals.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_integrals.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod semi_empirical_store_int_types.mod base_hooks.mod kinds.mod semi_empirical_int_num.mod memory_utilities.mod semi_empirical_int_ana.mod hfx_compression_methods.mod semi_empirical_int_gks.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_integrals.F semi_empirical_integrals.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:08:08 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_integrals.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_integrals.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'semi_empirical_integrals.mod' due to: semi_empirical_integrals.o /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_integrals.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod semi_empirical_store_int_types.mod base_hooks.mod kinds.mod semi_empirical_int_num.mod memory_utilities.mod semi_empirical_int_ana.mod hfx_compression_methods.mod semi_empirical_int_gks.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'se_fock_matrix_integrals.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/se_fock_matrix_integrals.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/ewalds_multipole_sr.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod semi_empirical_store_int_types.mod base_hooks.mod kinds.mod semi_empirical_integrals.mod semi_empirical_int_arrays.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/se_fock_matrix_integrals.F se_fock_matrix_integrals.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:08:10 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"se_fock_matrix_integrals.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' se_fock_matrix_integrals.F90 /build/cp2k-Q381vr/cp2k-8.1/src/se_fock_matrix_integrals.F:1105:68: 1105 | $: ewalds_multipole_sr_macro(mode="PURE_COULOMB") | ^ Warning: ‘ch_j’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/se_fock_matrix_integrals.F:1105:68: Warning: ‘ch_i’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'se_fock_matrix_integrals.mod' due to: se_fock_matrix_integrals.o /build/cp2k-Q381vr/cp2k-8.1/src/se_fock_matrix_integrals.F /build/cp2k-Q381vr/cp2k-8.1/src/ewalds_multipole_sr.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod semi_empirical_store_int_types.mod base_hooks.mod kinds.mod semi_empirical_integrals.mod semi_empirical_int_arrays.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ewalds_multipole.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/ewalds_multipole.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/ewalds_multipole_sr.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod atomic_kind_types.mod fist_neighbor_list_types.mod cell_types.mod fist_nonbond_env_types.mod dg_types.mod dg_rho0_types.mod particle_types.mod structure_factor_types.mod input_section_types.mod ewald_environment_types.mod damping_dipole_types.mod pw_pool_types.mod distribution_1d_types.mod ewald_pw_types.mod parallel_rng_types.mod mathlib.mod structure_factors.mod kinds.mod fist_neighbor_list_control.mod bibliography.mod base_hooks.mod mathconstants.mod cp_log_handling.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/ewalds_multipole.F ewalds_multipole.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:08:15 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ewalds_multipole.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ewalds_multipole.F90 /build/cp2k-Q381vr/cp2k-8.1/src/ewalds_multipole.F:600:46: 600 | $: ewalds_multipole_sr_macro(mode="SCREENED_COULOMB_ERF", store_energy=True, store_forces=True) | ^ Warning: ‘tij’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/ewalds_multipole.F:555:107: 555 | ptens12, ptens13, ptens21, ptens22, ptens23, ptens31, ptens32, ptens33, r, rab2, tij, & | ^ note: ‘tij’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/ewalds_multipole.F:554:40: 554 | REAL(KIND=dp) :: alpha, ch_i, ch_j, ef0_i, ef0_j, eloc, fac, fac_ij, ir, irab2, ptens11, & | ^ Warning: ‘ch_j’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/ewalds_multipole.F:554:34: 554 | REAL(KIND=dp) :: alpha, ch_i, ch_j, ef0_i, ef0_j, eloc, fac, fac_ij, ir, irab2, ptens11, & | ^ Warning: ‘ch_i’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/ewalds_multipole.F:481:46: 481 | $: ewalds_multipole_sr_macro(mode="SCREENED_COULOMB_GAUSS", damping=False, store_energy=True, store_forces=True) | ^ Warning: ‘tij’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/ewalds_multipole.F:382:32: 382 | rcut, tij, tmp, tmp1, tmp11, tmp12, tmp13, tmp2, tmp21, tmp22, tmp23, tmp31, tmp32, & | ^ note: ‘tij’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/ewalds_multipole.F:378:46: 378 | REAL(KIND=dp) :: alpha, beta, ch_i, ch_j, dampa_ij, dampa_ji, dampaexpi, dampaexpj, & | ^ Warning: ‘ch_j’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/ewalds_multipole.F:378:40: 378 | REAL(KIND=dp) :: alpha, beta, ch_i, ch_j, dampa_ij, dampa_ji, dampaexpi, dampaexpj, & | ^ Warning: ‘ch_i’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/ewalds_multipole.F:600:75: 600 | $: ewalds_multipole_sr_macro(mode="SCREENED_COULOMB_ERF", store_energy=True, store_forces=True) | ^ Warning: ‘efield2_sr.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/ewalds_multipole.F:161:70: 161 | efield2_sr | ^ note: ‘efield2_sr.dim[1].stride’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/ewalds_multipole.F:600:75: 600 | $: ewalds_multipole_sr_macro(mode="SCREENED_COULOMB_ERF", store_energy=True, store_forces=True) | ^ Warning: ‘efield2_sr.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/ewalds_multipole.F:161:70: 161 | efield2_sr | ^ note: ‘efield2_sr.offset’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/ewalds_multipole.F:600:72: 600 | $: ewalds_multipole_sr_macro(mode="SCREENED_COULOMB_ERF", store_energy=True, store_forces=True) | ^ Warning: ‘efield1_sr.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/ewalds_multipole.F:160:82: 160 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: efield1_lr, efield1_sr, efield2_lr, & | ^ note: ‘efield1_sr.dim[1].stride’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/ewalds_multipole.F:600:72: 600 | $: ewalds_multipole_sr_macro(mode="SCREENED_COULOMB_ERF", store_energy=True, store_forces=True) | ^ Warning: ‘efield1_sr.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/ewalds_multipole.F:160:82: 160 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: efield1_lr, efield1_sr, efield2_lr, & | ^ note: ‘efield1_sr.offset’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ewalds_multipole.mod' due to: ewalds_multipole.o /build/cp2k-Q381vr/cp2k-8.1/src/ewalds_multipole.F /build/cp2k-Q381vr/cp2k-8.1/src/ewalds_multipole_sr.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod atomic_kind_types.mod fist_neighbor_list_types.mod cell_types.mod fist_nonbond_env_types.mod dg_types.mod dg_rho0_types.mod particle_types.mod structure_factor_types.mod input_section_types.mod ewald_environment_types.mod damping_dipole_types.mod pw_pool_types.mod distribution_1d_types.mod ewald_pw_types.mod parallel_rng_types.mod mathlib.mod structure_factors.mod kinds.mod fist_neighbor_list_control.mod bibliography.mod base_hooks.mod mathconstants.mod cp_log_handling.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'se_fock_matrix_coulomb.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/se_fock_matrix_coulomb.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod multipole_types.mod fist_nonbond_env_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod semi_empirical_mpole_types.mod qs_energy_types.mod atprop_types.mod particle_types.mod semi_empirical_store_int_types.mod input_section_types.mod ewald_environment_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_poisson_types.mod distribution_1d_types.mod ewald_pw_types.mod input_constants.mod kinds.mod semi_empirical_mpole_methods.mod fist_neighbor_list_control.mod semi_empirical_utils.mod cp_output_handling.mod semi_empirical_int_arrays.mod base_hooks.mod se_fock_matrix_integrals.mod ewalds_multipole.mod cp_log_handling.mod message_passing.mod virial_methods.mod semi_empirical_integrals.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/se_fock_matrix_coulomb.F se_fock_matrix_coulomb.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:08:33 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"se_fock_matrix_coulomb.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' se_fock_matrix_coulomb.F90 /build/cp2k-Q381vr/cp2k-8.1/src/se_fock_matrix_coulomb.F:688:46: 688 | ALLOCATE (forces_g(3, forces_g_size)) | ^ Warning: ‘forces_g_size’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'se_fock_matrix_coulomb.mod' due to: se_fock_matrix_coulomb.o /build/cp2k-Q381vr/cp2k-8.1/src/se_fock_matrix_coulomb.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod multipole_types.mod fist_nonbond_env_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod semi_empirical_mpole_types.mod qs_energy_types.mod atprop_types.mod particle_types.mod semi_empirical_store_int_types.mod input_section_types.mod ewald_environment_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_poisson_types.mod distribution_1d_types.mod ewald_pw_types.mod input_constants.mod kinds.mod semi_empirical_mpole_methods.mod fist_neighbor_list_control.mod semi_empirical_utils.mod cp_output_handling.mod semi_empirical_int_arrays.mod base_hooks.mod se_fock_matrix_integrals.mod ewalds_multipole.mod cp_log_handling.mod message_passing.mod virial_methods.mod semi_empirical_integrals.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'se_fock_matrix_dbg.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/se_fock_matrix_dbg.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod qs_environment_types.mod semi_empirical_store_int_types.mod base_hooks.mod kinds.mod se_fock_matrix_coulomb.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/se_fock_matrix_dbg.F se_fock_matrix_dbg.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:08:42 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"se_fock_matrix_dbg.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' se_fock_matrix_dbg.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'se_fock_matrix_dbg.mod' due to: se_fock_matrix_dbg.o /build/cp2k-Q381vr/cp2k-8.1/src/se_fock_matrix_dbg.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod qs_environment_types.mod semi_empirical_store_int_types.mod base_hooks.mod kinds.mod se_fock_matrix_coulomb.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'se_fock_matrix_exchange.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/se_fock_matrix_exchange.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod multipole_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod particle_types.mod semi_empirical_store_int_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod input_constants.mod kinds.mod semi_empirical_utils.mod semi_empirical_int_arrays.mod base_hooks.mod se_fock_matrix_integrals.mod virial_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/se_fock_matrix_exchange.F se_fock_matrix_exchange.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:08:44 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"se_fock_matrix_exchange.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' se_fock_matrix_exchange.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'se_fock_matrix_exchange.mod' due to: se_fock_matrix_exchange.o /build/cp2k-Q381vr/cp2k-8.1/src/se_fock_matrix_exchange.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod multipole_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod particle_types.mod semi_empirical_store_int_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod input_constants.mod kinds.mod semi_empirical_utils.mod semi_empirical_int_arrays.mod base_hooks.mod se_fock_matrix_integrals.mod virial_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'se_fock_matrix.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/se_fock_matrix.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod atomic_kind_types.mod cp_control_types.mod qs_energy_types.mod atprop_types.mod qs_rho_types.mod particle_types.mod semi_empirical_store_int_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod input_constants.mod se_fock_matrix_coulomb.mod kinds.mod cp_output_handling.mod base_hooks.mod se_fock_matrix_dbg.mod se_fock_matrix_exchange.mod cp_log_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/se_fock_matrix.F se_fock_matrix.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:08:46 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"se_fock_matrix.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' se_fock_matrix.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'se_fock_matrix.mod' due to: se_fock_matrix.o /build/cp2k-Q381vr/cp2k-8.1/src/se_fock_matrix.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod atomic_kind_types.mod cp_control_types.mod qs_energy_types.mod atprop_types.mod qs_rho_types.mod particle_types.mod semi_empirical_store_int_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod input_constants.mod se_fock_matrix_coulomb.mod kinds.mod cp_output_handling.mod base_hooks.mod se_fock_matrix_dbg.mod se_fock_matrix_exchange.mod cp_log_handling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_ddapc.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/cp_ddapc.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cell_types.mod pw_types.mod cp_control_types.mod qs_energy_types.mod particle_types.mod input_section_types.mod qs_environment_types.mod pw_pool_types.mod pw_methods.mod input_constants.mod qs_integrate_potential.mod kinds.mod cp_ddapc_util.mod bibliography.mod cp_ddapc_forces.mod cp_output_handling.mod base_hooks.mod cp_log_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/cp_ddapc.F cp_ddapc.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:08:49 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_ddapc.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_ddapc.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_ddapc.mod' due to: cp_ddapc.o /build/cp2k-Q381vr/cp2k-8.1/src/cp_ddapc.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cell_types.mod pw_types.mod cp_control_types.mod qs_energy_types.mod particle_types.mod input_section_types.mod qs_environment_types.mod pw_pool_types.mod pw_methods.mod input_constants.mod qs_integrate_potential.mod kinds.mod cp_ddapc_util.mod bibliography.mod cp_ddapc_forces.mod cp_output_handling.mod base_hooks.mod cp_log_handling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_dispersion_pairpot.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod qs_force_types.mod virial_types.mod cp_parser_types.mod atprop_types.mod particle_types.mod molecule_types.mod qs_dispersion_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod input_constants.mod kinds.mod bibliography.mod cp_output_handling.mod base_hooks.mod mathconstants.mod physcon.mod cp_files.mod cp_log_handling.mod memory_utilities.mod message_passing.mod virial_methods.mod cp_parser_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F qs_dispersion_pairpot.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:08:53 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dispersion_pairpot.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dispersion_pairpot.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F:1599:33: 1599 | e8tot = e8tot - e8 | ^ Warning: ‘e8’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F:1598:33: 1598 | e6tot = e6tot - e6 | ^ Warning: ‘e6’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F:1617:53: 1617 | fdij(:) = (de6 + de8)*rij(:)/dr*fac | ^ Warning: ‘de8’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F:1617:53: Warning: ‘de6’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F:1789:117: 1789 | force(jkind)%dispersion(:, atom_b) = force(jkind)%dispersion(:, atom_b) + fdij(:) | ^ Warning: ‘atom_b’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F:1788:117: 1788 | force(ikind)%dispersion(:, atom_a) = force(ikind)%dispersion(:, atom_a) - fdij(:) | ^ Warning: ‘atom_a’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F:2000:111: 2000 | elrc9 = elrc9 - s9*64._dp*twopi*REAL(na*nb*nc, KIND=dp)*c9/(6._dp*rcut**3*cell%deth**2) | ^ Warning: ‘s9’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F:1639:27: 1639 | ELSE IF (idmp == 2) THEN | ^ Warning: ‘idmp’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F:2102:10: 2102 | IF (domol) THEN | ^ Warning: ‘domol’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F:1545:83: 1545 | CALL virial_pair_force(atstr(:, :, iatom), -0.5_dp, fdij, rij) | ^ Warning: ‘atstr.dim[2].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F:1545:83: Warning: ‘atstr.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F:1819:101: 1819 | CALL virial_pair_force(atstr(:, :, katom), -0.5_dp, fdij, rca) | ^ Warning: ‘atstr.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F:1219:65: 1219 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: atstr | ^ Warning: ‘atstr.dim[1].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F:1219:65: Warning: ‘atstr.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F:1219:65: Warning: ‘atstr.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F:1219:65: Warning: ‘atstr.dim[0].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F:1219:65: Warning: ‘atstr.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F:1545:83: 1545 | CALL virial_pair_force(atstr(:, :, iatom), -0.5_dp, fdij, rij) | ^ Warning: ‘atstr.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F:1550:68: 1550 | atener(iatom) = atener(iatom) - 0.5_dp*xp*fdmp*fac | ^ Warning: ‘atener.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F:1550:68: Warning: ‘atener.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F:1550:68: Warning: ‘atener.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_dispersion_pairpot.mod' due to: qs_dispersion_pairpot.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_pairpot.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod qs_force_types.mod virial_types.mod cp_parser_types.mod atprop_types.mod particle_types.mod molecule_types.mod qs_dispersion_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod input_constants.mod kinds.mod bibliography.mod cp_output_handling.mod base_hooks.mod mathconstants.mod physcon.mod cp_files.mod cp_log_handling.mod memory_utilities.mod message_passing.mod virial_methods.mod cp_parser_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_charge_mixing.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_charge_mixing.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_density_mixing_types.mod base_hooks.mod kinds.mod mathlib.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_charge_mixing.F qs_charge_mixing.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:09:07 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_charge_mixing.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_charge_mixing.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_charge_mixing.mod' due to: qs_charge_mixing.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_charge_mixing.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_density_mixing_types.mod base_hooks.mod kinds.mod mathlib.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_condnum.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_condnum.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod kinds.mod mathlib.mod arnoldi_api.mod cp_fm_struct.mod cp_blacs_env.mod cp_fm_diag.mod cp_fm_basic_linalg.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_condnum.F qs_condnum.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:09:09 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_condnum.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_condnum.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_condnum.mod' due to: qs_condnum.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_condnum.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod kinds.mod mathlib.mod arnoldi_api.mod cp_fm_struct.mod cp_blacs_env.mod cp_fm_diag.mod cp_fm_basic_linalg.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xtb_matrices.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xtb_matrices.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod basis_set_types.mod qs_force_types.mod block_p_types.mod cp_control_types.mod virial_types.mod xtb_types.mod qs_energy_types.mod kpoint_types.mod atprop_types.mod qs_rho_types.mod particle_types.mod qs_mo_types.mod qs_dispersion_types.mod pair_potential_types.mod input_section_types.mod ewald_environment_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_dispersion_pairpot.mod cp_dbcsr_cp2k_link.mod cp_dbcsr_output.mod string_utilities.mod mulliken.mod xtb_parameters.mod ai_overlap.mod kinds.mod cp_blacs_env.mod efield_tb_methods.mod fparser.mod cp_output_handling.mod base_hooks.mod pair_potential.mod ai_contraction.mod qs_overlap.mod xtb_coulomb.mod qs_charge_mixing.mod cp_log_handling.mod qs_integral_utils.mod qs_condnum.mod pair_potential_util.mod orbital_pointers.mod message_passing.mod virial_methods.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xtb_matrices.F xtb_matrices.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:09:11 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xtb_matrices.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xtb_matrices.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xtb_matrices.F:1466:22: 1466 | IF (iw > 0) WRITE (iw, *) "TESTING ", TRIM(name_atm_a), TRIM(name_atm_b), & | ^ Warning: ‘iw’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xtb_matrices.F:1442:75: 1442 | INTEGER :: ikind, ingp, iw, jkind | ^ note: ‘iw’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xtb_matrices.F:1517:94: 1517 | SUBROUTINE xb_interaction(exb, neighbor_atoms, atom_of_kind, kind_of, sab_xb, kx, kx2, rcab, & | ^ Warning: ‘rcab.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xtb_matrices.F:161:95: 161 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :) :: dfblock, huckel, kcnlk, owork, rcab | ^ note: ‘rcab.dim[1].stride’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xtb_matrices.F:1399:19: 1399 | IF (use_virial) THEN | ^ Warning: ‘use_virial’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xtb_matrices.F:154:46: 154 | omit_headers, use_arnoldi, use_virial, xb_inter | ^ note: ‘use_virial’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xtb_matrices.mod' due to: xtb_matrices.o /build/cp2k-Q381vr/cp2k-8.1/src/xtb_matrices.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod basis_set_types.mod qs_force_types.mod block_p_types.mod cp_control_types.mod virial_types.mod xtb_types.mod qs_energy_types.mod kpoint_types.mod atprop_types.mod qs_rho_types.mod particle_types.mod qs_mo_types.mod qs_dispersion_types.mod pair_potential_types.mod input_section_types.mod ewald_environment_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_dispersion_pairpot.mod cp_dbcsr_cp2k_link.mod cp_dbcsr_output.mod string_utilities.mod mulliken.mod xtb_parameters.mod ai_overlap.mod kinds.mod cp_blacs_env.mod efield_tb_methods.mod fparser.mod cp_output_handling.mod base_hooks.mod pair_potential.mod ai_contraction.mod qs_overlap.mod xtb_coulomb.mod qs_charge_mixing.mod cp_log_handling.mod qs_integral_utils.mod qs_condnum.mod pair_potential_util.mod orbital_pointers.mod message_passing.mod virial_methods.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'admm_dm_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/admm_dm_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod task_list_types.mod cp_control_types.mod qs_ks_types.mod admm_dm_types.mod pw_types.mod base_hooks.mod cp_log_handling.mod kinds.mod iterate_matrix.mod input_constants.mod qs_collocate_density.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/admm_dm_methods.F admm_dm_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:09:25 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"admm_dm_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' admm_dm_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'admm_dm_methods.mod' due to: admm_dm_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/admm_dm_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod task_list_types.mod cp_control_types.mod qs_ks_types.mod admm_dm_types.mod pw_types.mod base_hooks.mod cp_log_handling.mod kinds.mod iterate_matrix.mod input_constants.mod qs_collocate_density.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmm_image_charge.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_image_charge.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cell_types.mod pw_types.mod cp_control_types.mod virial_types.mod realspace_grid_types.mod qs_energy_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qmmm_types_low.mod pw_env_types.mod pw_poisson_types.mod pw_methods.mod input_constants.mod pw_poisson_methods.mod qs_integrate_potential.mod kinds.mod cp_output_handling.mod qs_collocate_density.mod base_hooks.mod util.mod mathconstants.mod eri_mme_integrate.mod cp_files.mod ao_util.mod cp_log_handling.mod cp_eri_mme_interface.mod memory_utilities.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_image_charge.F qmmm_image_charge.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:09:29 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_image_charge.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_image_charge.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmm_image_charge.mod' due to: qmmm_image_charge.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_image_charge.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cell_types.mod pw_types.mod cp_control_types.mod virial_types.mod realspace_grid_types.mod qs_energy_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qmmm_types_low.mod pw_env_types.mod pw_poisson_types.mod pw_methods.mod input_constants.mod pw_poisson_methods.mod qs_integrate_potential.mod kinds.mod cp_output_handling.mod qs_collocate_density.mod base_hooks.mod util.mod mathconstants.mod eri_mme_integrate.mod cp_files.mod ao_util.mod cp_log_handling.mod cp_eri_mme_interface.mod memory_utilities.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'efield_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/efield_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod cp_para_types.mod qs_environment_types.mod qs_force_types.mod qs_rho_types.mod cp_control_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod base_hooks.mod kinds.mod kahan_sum.mod mathconstants.mod input_constants.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/efield_utils.F efield_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:09:35 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"efield_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' efield_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'efield_utils.mod' due to: efield_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/efield_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod cp_para_types.mod qs_environment_types.mod qs_force_types.mod qs_rho_types.mod cp_control_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod base_hooks.mod kinds.mod kahan_sum.mod mathconstants.mod input_constants.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'admm_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/admm_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_local_rho_types.mod admm_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod basis_set_types.mod qs_oce_types.mod qs_force_types.mod cp_control_types.mod distribution_2d_types.mod qs_energy_types.mod qs_rho_types.mod task_list_types.mod particle_types.mod paw_proj_set_types.mod qs_mo_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod distribution_1d_types.mod cp_dbcsr_cp2k_link.mod cp_fm_diag.mod cp_dbcsr_output.mod input_constants.mod qs_vxc_atom.mod kinds.mod bibliography.mod cp_output_handling.mod qs_collocate_density.mod qs_ks_atom.mod base_hooks.mod qs_rho_atom_methods.mod qs_overlap.mod cp_fm_basic_linalg.mod qs_gapw_densities.mod cp_fm_cholesky.mod cp_gemm_interface.mod qs_oce_methods.mod task_list_methods.mod qs_vxc.mod cp_log_handling.mod cp_dbcsr_operations.mod qs_neighbor_lists.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/admm_methods.F admm_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:09:38 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"admm_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' admm_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'admm_methods.mod' due to: admm_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/admm_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_local_rho_types.mod admm_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod basis_set_types.mod qs_oce_types.mod qs_force_types.mod cp_control_types.mod distribution_2d_types.mod qs_energy_types.mod qs_rho_types.mod task_list_types.mod particle_types.mod paw_proj_set_types.mod qs_mo_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod distribution_1d_types.mod cp_dbcsr_cp2k_link.mod cp_fm_diag.mod cp_dbcsr_output.mod input_constants.mod qs_vxc_atom.mod kinds.mod bibliography.mod cp_output_handling.mod qs_collocate_density.mod qs_ks_atom.mod base_hooks.mod qs_rho_atom_methods.mod qs_overlap.mod cp_fm_basic_linalg.mod qs_gapw_densities.mod cp_fm_cholesky.mod cp_gemm_interface.mod qs_oce_methods.mod task_list_methods.mod qs_vxc.mod cp_log_handling.mod cp_dbcsr_operations.mod qs_neighbor_lists.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_efield_local.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_efield_local.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod qs_force_types.mod cp_control_types.mod qs_energy_types.mod qs_rho_types.mod qs_period_efield_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_moments.mod kinds.mod ai_moments.mod base_hooks.mod orbital_pointers.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_efield_local.F qs_efield_local.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:09:48 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_efield_local.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_efield_local.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_efield_local.mod' due to: qs_efield_local.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_efield_local.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod qs_force_types.mod cp_control_types.mod qs_energy_types.mod qs_rho_types.mod qs_period_efield_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_moments.mod kinds.mod ai_moments.mod base_hooks.mod orbital_pointers.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'hfx_derivatives.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod admm_types.mod atomic_kind_types.mod cell_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod gamma.mod hfx_compression_methods.mod hfx_screening_methods.mod input_constants.mod kinds.mod cp_output_handling.mod hfx_libint_interface.mod base_hooks.mod util.mod mathconstants.mod machine.mod hfx_load_balance_methods.mod libint_wrapper.mod cp_files.mod cp_log_handling.mod hfx_pair_list_methods.mod orbital_pointers.mod message_passing.mod hfx_communication.mod t_c_g0.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F hfx_derivatives.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:09:51 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_derivatives.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_derivatives.F90 /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:178:60: 178 | max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, shm_pmax_block, & | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_4].dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:178:60: Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_4].dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90:224:36: 224 | pmax_4 = ptr_p_4(jset, kset) | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_4].span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:178:60: 178 | max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, shm_pmax_block, & | ^ note: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_4].span’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:178:60: Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_4].offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90:224:36: 224 | pmax_4 = ptr_p_4(jset, kset) | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_4].data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:178:60: 178 | max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, shm_pmax_block, & | ^ note: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_4].data’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:178:51: 178 | max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, shm_pmax_block, & | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_3].dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:178:51: Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_3].dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90:223:36: 223 | pmax_3 = ptr_p_3(iset, lset) | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_3].span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:178:51: 178 | max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, shm_pmax_block, & | ^ note: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_3].span’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:178:51: Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_3].offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90:223:36: 223 | pmax_3 = ptr_p_3(iset, lset) | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_3].data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:178:51: 178 | max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, shm_pmax_block, & | ^ note: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_3].data’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:178:42: 178 | max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, shm_pmax_block, & | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_2].dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:178:42: Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_2].dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90:222:36: 222 | pmax_2 = ptr_p_2(jset, lset) | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_2].span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:178:42: 178 | max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, shm_pmax_block, & | ^ note: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_2].span’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:178:42: Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_2].offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90:222:36: 222 | pmax_2 = ptr_p_2(jset, lset) | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_2].data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:178:42: 178 | max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, shm_pmax_block, & | ^ note: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_2].data’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:178:33: 178 | max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, shm_pmax_block, & | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_1].dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:178:33: Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_1].dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90:221:36: 221 | pmax_1 = ptr_p_1(iset, kset) | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_1].span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:178:33: 178 | max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, shm_pmax_block, & | ^ note: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_1].span’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:178:33: Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_1].offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90:221:36: 221 | pmax_1 = ptr_p_1(iset, kset) | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_1].data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:178:33: 178 | max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, shm_pmax_block, & | ^ note: ‘MEM[(struct array02_real(kind=8) &)&ptr_p_1].data’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:142:38: 142 | sphi_d_u2, sphi_d_u3, swap_id, tmp_i4, unit_id | ^ Warning: ‘swap_id’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:1470:44: 1470 | IF (use_virial .AND. spherical_estimate_virial*pmax_entry >= eps_schwarz) THEN | ^ Warning: ‘spherical_estimate_virial’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:167:81: 167 | rb(3), rc(3), rcd2, rd(3), spherical_estimate, spherical_estimate_virial, symm_fac, & | ^ note: ‘spherical_estimate_virial’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:1268:80: 1268 | use_disk_storage) | ^ Warning: ‘integral_containers.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:195:79: 195 | TYPE(hfx_container_type), DIMENSION(:), POINTER :: integral_containers | ^ note: ‘integral_containers.dim[0].stride’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:1268:80: 1268 | use_disk_storage) | ^ Warning: ‘integral_containers.span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:195:79: 195 | TYPE(hfx_container_type), DIMENSION(:), POINTER :: integral_containers | ^ note: ‘integral_containers.span’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:1268:80: 1268 | use_disk_storage) | ^ Warning: ‘integral_containers.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:195:79: 195 | TYPE(hfx_container_type), DIMENSION(:), POINTER :: integral_containers | ^ note: ‘integral_containers.offset’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:1268:80: 1268 | use_disk_storage) | ^ Warning: ‘integral_containers.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:195:79: 195 | TYPE(hfx_container_type), DIMENSION(:), POINTER :: integral_containers | ^ note: ‘integral_containers.data’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:1375:83: 1375 | use_disk_storage) | ^ Warning: ‘integral_caches.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:193:75: 193 | TYPE(hfx_cache_type), DIMENSION(:), POINTER :: integral_caches | ^ note: ‘integral_caches.dim[0].stride’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:1375:83: 1375 | use_disk_storage) | ^ Warning: ‘integral_caches.span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:193:75: 193 | TYPE(hfx_cache_type), DIMENSION(:), POINTER :: integral_caches | ^ note: ‘integral_caches.span’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:1375:83: 1375 | use_disk_storage) | ^ Warning: ‘integral_caches.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:193:75: 193 | TYPE(hfx_cache_type), DIMENSION(:), POINTER :: integral_caches | ^ note: ‘integral_caches.offset’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:1375:83: 1375 | use_disk_storage) | ^ Warning: ‘integral_caches.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:193:75: 193 | TYPE(hfx_cache_type), DIMENSION(:), POINTER :: integral_caches | ^ note: ‘integral_caches.data’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:1354:97: 1354 | use_disk_storage, max_val_memory) | ^ Warning: ‘maxval_container’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:196:76: 196 | TYPE(hfx_container_type), POINTER :: maxval_container | ^ note: ‘maxval_container’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:1354:97: 1354 | use_disk_storage, max_val_memory) | ^ Warning: ‘maxval_cache’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F:194:72: 194 | TYPE(hfx_cache_type), POINTER :: maxval_cache | ^ note: ‘maxval_cache’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'hfx_derivatives.mod' due to: hfx_derivatives.o /build/cp2k-Q381vr/cp2k-8.1/src/hfx_derivatives.F /build/cp2k-Q381vr/cp2k-8.1/src/hfx_get_pmax_val.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod admm_types.mod atomic_kind_types.mod cell_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod gamma.mod hfx_compression_methods.mod hfx_screening_methods.mod input_constants.mod kinds.mod cp_output_handling.mod hfx_libint_interface.mod base_hooks.mod util.mod mathconstants.mod machine.mod hfx_load_balance_methods.mod libint_wrapper.mod cp_files.mod cp_log_handling.mod hfx_pair_list_methods.mod orbital_pointers.mod message_passing.mod hfx_communication.mod t_c_g0.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_adiabatic_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc_adiabatic_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod qs_environment_types.mod qs_mo_types.mod base_hooks.mod kinds.mod mathconstants.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc_adiabatic_methods.F xc_adiabatic_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:10:09 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc_adiabatic_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_adiabatic_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_adiabatic_methods.mod' due to: xc_adiabatic_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/xc_adiabatic_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod qs_environment_types.mod qs_mo_types.mod base_hooks.mod kinds.mod mathconstants.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_adiabatic_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc_adiabatic_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod cp_para_types.mod qs_environment_types.mod qs_rho_types.mod cp_control_types.mod qs_ks_types.mod input_section_types.mod pw_types.mod base_hooks.mod qs_vxc.mod kinds.mod hfx_derivatives.mod xc_adiabatic_methods.mod input_constants.mod hfx_communication.mod qs_vxc_atom.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc_adiabatic_utils.F xc_adiabatic_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:10:10 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc_adiabatic_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_adiabatic_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_adiabatic_utils.mod' due to: xc_adiabatic_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/xc_adiabatic_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod cp_para_types.mod qs_environment_types.mod qs_rho_types.mod cp_control_types.mod qs_ks_types.mod input_section_types.mod pw_types.mod base_hooks.mod qs_vxc.mod kinds.mod hfx_derivatives.mod xc_adiabatic_methods.mod input_constants.mod hfx_communication.mod qs_vxc_atom.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_tensors.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_tensors.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod qs_tensors_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod block_p_types.mod cp_control_types.mod distribution_2d_types.mod kpoint_types.mod particle_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod distribution_1d_types.mod cp_dbcsr_cp2k_link.mod cp_array_utils.mod gamma.mod hfx_compression_methods.mod ai_contraction_sphi.mod input_constants.mod ai_overlap.mod kinds.mod base_hooks.mod ai_contraction.mod libint_wrapper.mod cp_files.mod libint_2c_3c.mod orbital_pointers.mod qs_neighbor_lists.mod t_c_g0.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_tensors.F qs_tensors.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:10:13 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tensors.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tensors.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_tensors.F:783:49: 783 | ak%array(1:blk_cnt) = tmp(:) | ^ Warning: ‘blk_cnt’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_tensors.F:617:24: 617 | INTEGER :: blk_cnt, handle, i, i_img, iatom, iblk, ikind, iproc, j_img, jatom, jcell, jkind, & | ^ note: ‘blk_cnt’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_tensors.mod' due to: qs_tensors.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_tensors.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod qs_tensors_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod block_p_types.mod cp_control_types.mod distribution_2d_types.mod kpoint_types.mod particle_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod distribution_1d_types.mod cp_dbcsr_cp2k_link.mod cp_array_utils.mod gamma.mod hfx_compression_methods.mod ai_contraction_sphi.mod input_constants.mod ai_overlap.mod kinds.mod base_hooks.mod ai_contraction.mod libint_wrapper.mod cp_files.mod libint_2c_3c.mod orbital_pointers.mod qs_neighbor_lists.mod t_c_g0.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'hfx_ri.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/hfx_ri.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod qs_tensors_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod distribution_2d_types.mod particle_types.mod qs_mo_types.mod cp_para_types.mod qs_loc_types.mod qs_environment_types.mod qs_neighbor_list_types.mod arnoldi_api.mod cp_array_utils.mod qs_loc_utils.mod input_constants.mod particle_methods.mod kinds.mod cp_blacs_env.mod cp_dbcsr_diag.mod input_cp2k_hfx.mod base_hooks.mod util.mod qs_loc_methods.mod machine.mod qs_interactions.mod qs_integral_utils.mod iterate_matrix.mod message_passing.mod cp_dbcsr_cholesky.mod cp_dbcsr_operations.mod qs_tensors.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/hfx_ri.F hfx_ri.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:10:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_ri.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_ri.F90 /build/cp2k-Q381vr/cp2k-8.1/src/hfx_ri.F:701:35: 701 | SUBROUTINE sort_unique_blkind_2d(blk_ind) | ^ Warning: ‘sort_unique_blkind_2d’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_ri.F:863:70: 863 | DEALLOCATE (occupied_orbs, occupied_evals, homo_localized) | ^ Warning: ‘occupied_orbs.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_ri.F:863:70: Warning: ‘occupied_evals.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'hfx_ri.mod' due to: hfx_ri.o /build/cp2k-Q381vr/cp2k-8.1/src/hfx_ri.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod qs_tensors_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod distribution_2d_types.mod particle_types.mod qs_mo_types.mod cp_para_types.mod qs_loc_types.mod qs_environment_types.mod qs_neighbor_list_types.mod arnoldi_api.mod cp_array_utils.mod qs_loc_utils.mod input_constants.mod particle_methods.mod kinds.mod cp_blacs_env.mod cp_dbcsr_diag.mod input_cp2k_hfx.mod base_hooks.mod util.mod qs_loc_methods.mod machine.mod qs_interactions.mod qs_integral_utils.mod iterate_matrix.mod message_passing.mod cp_dbcsr_cholesky.mod cp_dbcsr_operations.mod qs_tensors.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'hfx_pw_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/hfx_pw_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_poisson_types.mod pw_methods.mod input_constants.mod pw_poisson_methods.mod kinds.mod cp_output_handling.mod qs_collocate_density.mod base_hooks.mod mathconstants.mod cp_log_handling.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/hfx_pw_methods.F hfx_pw_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:10:34 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_pw_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_pw_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'hfx_pw_methods.mod' due to: hfx_pw_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/hfx_pw_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_poisson_types.mod pw_methods.mod input_constants.mod pw_poisson_methods.mod kinds.mod cp_output_handling.mod qs_collocate_density.mod base_hooks.mod mathconstants.mod cp_log_handling.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'hfx_admm_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/hfx_admm_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod qs_local_rho_types.mod admm_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod pw_types.mod basis_set_types.mod qs_force_types.mod basis_set_container_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod qs_rho_types.mod particle_types.mod rt_propagation_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod external_potential_types.mod pw_poisson_types.mod admm_dm_types.mod hfx_derivatives.mod input_constants.mod hfx_energy_potential.mod kinds.mod xc_adiabatic_utils.mod base_hooks.mod admm_methods.mod hfx_ri.mod qs_rho_atom_methods.mod qs_interactions.mod hfx_pw_methods.mod cp_log_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/hfx_admm_utils.F hfx_admm_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:10:37 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_admm_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_admm_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/src/hfx_admm_utils.F:1214:25: 1214 | energy%ex = ehfx | ^ Warning: ‘ehfx’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/hfx_admm_utils.F:550:31: 550 | energy%ex = ehfx + ehfxrt | ^ Warning: ‘ehfxrt’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'hfx_admm_utils.mod' due to: hfx_admm_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/hfx_admm_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod qs_local_rho_types.mod admm_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod pw_types.mod basis_set_types.mod qs_force_types.mod basis_set_container_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod qs_rho_types.mod particle_types.mod rt_propagation_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod external_potential_types.mod pw_poisson_types.mod admm_dm_types.mod hfx_derivatives.mod input_constants.mod hfx_energy_potential.mod kinds.mod xc_adiabatic_utils.mod base_hooks.mod admm_methods.mod hfx_ri.mod qs_rho_atom_methods.mod qs_interactions.mod hfx_pw_methods.mod cp_log_handling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rtp_admm_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/rtp_admm_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_ks_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod qs_rho_types.mod task_list_types.mod particle_types.mod rt_propagation_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod input_constants.mod kinds.mod qs_collocate_density.mod base_hooks.mod mathconstants.mod cp_fm_basic_linalg.mod cp_fm_cholesky.mod cp_gemm_interface.mod hfx_admm_utils.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/rtp_admm_methods.F rtp_admm_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:10:42 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rtp_admm_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rtp_admm_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rtp_admm_methods.mod' due to: rtp_admm_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/rtp_admm_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_ks_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod qs_rho_types.mod task_list_types.mod particle_types.mod rt_propagation_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod input_constants.mod kinds.mod qs_collocate_density.mod base_hooks.mod mathconstants.mod cp_fm_basic_linalg.mod cp_fm_cholesky.mod cp_gemm_interface.mod hfx_admm_utils.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_sccs.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_sccs.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod pw_types.mod cp_control_types.mod realspace_grid_types.mod qs_energy_types.mod qs_rho_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_poisson_types.mod particle_list_types.mod pw_methods.mod input_constants.mod pw_poisson_methods.mod cp_realspace_grid_cube.mod kinds.mod cp_output_handling.mod base_hooks.mod mathconstants.mod cp_units.mod rs_methods.mod cp_log_handling.mod kahan_sum.mod message_passing.mod cp_realspace_grid_init.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_sccs.F qs_sccs.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:10:45 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_sccs.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_sccs.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_sccs.F:355:38: 355 | filename = mpi_filename | 1 Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/qs_sccs.F:440:41: 440 | filename = mpi_filename | 1 Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/qs_sccs.F:723:38: 723 | filename = mpi_filename | 1 Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/qs_sccs.F:787:38: 787 | filename = mpi_filename | 1 Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/qs_sccs.F:823:38: 823 | filename = mpi_filename | 1 Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/qs_sccs.F:1228:81: 1228 | !$OMP SHARED(ln_rho_max,norm_drho_elec,rho_elec,q,rho_max,rho_min,ub) | ^ Warning: ‘q’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_sccs.F:1206:73: 1206 | ln_rho_min, q, rho, t, x, y | ^ note: ‘q’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/qs_sccs.F:1228:81: 1228 | !$OMP SHARED(ln_rho_max,norm_drho_elec,rho_elec,q,rho_max,rho_min,ub) | ^ Warning: ‘ln_rho_max’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_sccs.F:1205:92: 1205 | REAL(KIND=dp) :: diff, e, eps_elec, f, ln_rho_max, & | ^ note: ‘ln_rho_max’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/qs_sccs.F:972:63: 972 | !$OMP SHARED(ln_rho_max,rho_elec,q,rho_max,rho_min) | ^ Warning: ‘q’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_sccs.F:951:61: 951 | q, rho, t, x, y | ^ note: ‘q’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/qs_sccs.F:972:63: 972 | !$OMP SHARED(ln_rho_max,rho_elec,q,rho_max,rho_min) | ^ Warning: ‘ln_rho_max’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_sccs.F:950:87: 950 | REAL(KIND=dp) :: diff, dq, dt, f, ln_rho_max, ln_rho_min, & | ^ note: ‘ln_rho_max’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/qs_sccs.F:972:63: 972 | !$OMP SHARED(ln_rho_max,rho_elec,q,rho_max,rho_min) | ^ Warning: ‘dq’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_sccs.F:950:68: 950 | REAL(KIND=dp) :: diff, dq, dt, f, ln_rho_max, ln_rho_min, & | ^ note: ‘dq’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_sccs.mod' due to: qs_sccs.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_sccs.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod pw_types.mod cp_control_types.mod realspace_grid_types.mod qs_energy_types.mod qs_rho_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_poisson_types.mod particle_list_types.mod pw_methods.mod input_constants.mod pw_poisson_methods.mod cp_realspace_grid_cube.mod kinds.mod cp_output_handling.mod base_hooks.mod mathconstants.mod cp_units.mod rs_methods.mod cp_log_handling.mod kahan_sum.mod message_passing.mod cp_realspace_grid_init.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_efield_berry.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_efield_berry.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod qs_force_types.mod block_p_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod qs_period_efield_types.mod particle_types.mod cp_cfm_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_fm_struct.mod qs_moments.mod kinds.mod ai_moments.mod cp_cfm_basic_linalg.mod base_hooks.mod mathconstants.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod orbital_pointers.mod message_passing.mod virial_methods.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_efield_berry.F qs_efield_berry.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:10:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_efield_berry.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_efield_berry.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_efield_berry.F:1050:95: 1050 | force_tmp(iatom, :, i) = force_tmp(iatom, :, i) - fab*hmat(i, idir)*forcea(:) | ^ Warning: ‘force_tmp.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_efield_berry.F:1050:95: Warning: ‘force_tmp.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_efield_berry.F:691:85: 691 | REAL(dp), DIMENSION(:, :, :), POINTER :: dcosab, dsinab, force_tmp | ^ Warning: ‘force_tmp.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_efield_berry.F:691:85: Warning: ‘force_tmp.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_efield_berry.mod' due to: qs_efield_berry.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_efield_berry.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod qs_force_types.mod block_p_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod qs_period_efield_types.mod particle_types.mod cp_cfm_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_fm_struct.mod qs_moments.mod kinds.mod ai_moments.mod cp_cfm_basic_linalg.mod base_hooks.mod mathconstants.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod orbital_pointers.mod message_passing.mod virial_methods.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_core_energies.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_core_energies.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod cp_para_types.mod qs_environment_types.mod atprop_types.mod qs_force_types.mod qs_neighbor_list_types.mod distribution_1d_types.mod particle_types.mod qs_kind_types.mod virial_types.mod atomic_kind_types.mod base_hooks.mod kinds.mod mathconstants.mod message_passing.mod virial_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_core_energies.F qs_core_energies.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:11:00 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_core_energies.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_core_energies.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_core_energies.mod' due to: qs_core_energies.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_core_energies.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod cp_para_types.mod qs_environment_types.mod atprop_types.mod qs_force_types.mod qs_neighbor_list_types.mod distribution_1d_types.mod particle_types.mod qs_kind_types.mod virial_types.mod atomic_kind_types.mod base_hooks.mod kinds.mod mathconstants.mod message_passing.mod virial_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'dft_plus_u.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/dft_plus_u.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_kind_types.mod atomic_kind_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod qs_energy_types.mod qs_rho_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod mathlib.mod cp_fm_struct.mod cp_dbcsr_output.mod input_constants.mod particle_methods.mod kinds.mod cp_blacs_env.mod bibliography.mod cp_output_handling.mod base_hooks.mod orbital_symbols.mod physcon.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_log_handling.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/dft_plus_u.F dft_plus_u.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:11:02 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dft_plus_u.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dft_plus_u.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'dft_plus_u.mod' due to: dft_plus_u.o /build/cp2k-Q381vr/cp2k-8.1/src/dft_plus_u.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_kind_types.mod atomic_kind_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod qs_energy_types.mod qs_rho_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod mathlib.mod cp_fm_struct.mod cp_dbcsr_output.mod input_constants.mod particle_methods.mod kinds.mod cp_blacs_env.mod bibliography.mod cp_output_handling.mod base_hooks.mod orbital_symbols.mod physcon.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_log_handling.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_scf_output.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_output.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_cdft_types.mod qs_scf_types.mod qs_kind_types.mod atomic_kind_types.mod qs_cdft_opt_types.mod cp_control_types.mod qs_charges_types.mod ps_implicit_types.mod qs_energy_types.mod qs_rho_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod pw_env_types.mod pw_poisson_types.mod cp_dbcsr_output.mod qs_mo_methods.mod input_constants.mod qs_mo_io.mod kinds.mod qmmm_image_charge.mod cp_output_handling.mod base_hooks.mod physcon.mod machine.mod cp_units.mod cp_log_handling.mod kahan_sum.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_output.F qs_scf_output.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:11:12 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_output.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_output.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_scf_output.mod' due to: qs_scf_output.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_output.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_cdft_types.mod qs_scf_types.mod qs_kind_types.mod atomic_kind_types.mod qs_cdft_opt_types.mod cp_control_types.mod qs_charges_types.mod ps_implicit_types.mod qs_energy_types.mod qs_rho_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod pw_env_types.mod pw_poisson_types.mod cp_dbcsr_output.mod qs_mo_methods.mod input_constants.mod qs_mo_io.mod kinds.mod qmmm_image_charge.mod cp_output_handling.mod base_hooks.mod physcon.mod machine.mod cp_units.mod cp_log_handling.mod kahan_sum.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'atom_xc.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/atom_xc.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod atom_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod mathconstants.mod atom_utils.mod xc_atom.mod input_constants.mod xc_derivatives.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/atom_xc.F atom_xc.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:11:16 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_xc.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_xc.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'atom_xc.mod' due to: atom_xc.o /build/cp2k-Q381vr/cp2k-8.1/src/atom_xc.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod atom_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod base_hooks.mod kinds.mod mathconstants.mod atom_utils.mod xc_atom.mod input_constants.mod xc_derivatives.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_parsing.mod' due to: input_parsing.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_check.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_check.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod input_val_types.mod input_keyword_types.mod cp_parser_types.mod base_hooks.mod cp_log_handling.mod input_parsing.mod kinds.mod memory_utilities.mod input_constants.mod xc_input_constants.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_check.F input_cp2k_check.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:11:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_check.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_check.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_check.mod' due to: input_cp2k_check.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_check.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod input_val_types.mod input_keyword_types.mod cp_parser_types.mod base_hooks.mod cp_log_handling.mod input_parsing.mod kinds.mod memory_utilities.mod input_constants.mod xc_input_constants.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'atom_output.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/atom_output.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atom_types.mod input_section_types.mod base_hooks.mod kinds.mod mathconstants.mod physcon.mod atom_utils.mod input_cp2k_check.mod xc_derivatives.mod xc_libxc.mod input_constants.mod periodic_table.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/atom_output.F atom_output.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:11:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_output.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_output.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'atom_output.mod' due to: atom_output.o /build/cp2k-Q381vr/cp2k-8.1/src/atom_output.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atom_types.mod input_section_types.mod base_hooks.mod kinds.mod mathconstants.mod physcon.mod atom_utils.mod input_cp2k_check.mod xc_derivatives.mod xc_libxc.mod input_constants.mod periodic_table.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'atom_optimization.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/atom_optimization.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atom_types.mod base_hooks.mod lapack.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/atom_optimization.F atom_optimization.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:11:29 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_optimization.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_optimization.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'atom_optimization.mod' due to: atom_optimization.o /build/cp2k-Q381vr/cp2k-8.1/src/atom_optimization.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atom_types.mod base_hooks.mod lapack.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'atom_electronic_structure.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/atom_electronic_structure.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod base_hooks.mod kinds.mod atom_xc.mod atom_output.mod atom_utils.mod input_constants.mod atom_optimization.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/atom_electronic_structure.F atom_electronic_structure.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:11:31 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_electronic_structure.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_electronic_structure.F90 /build/cp2k-Q381vr/cp2k-8.1/src/atom_electronic_structure.F:691:13: 691 | IF (need_xc) THEN | ^ Warning: ‘need_xc’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/atom_electronic_structure.F:454:75: 454 | need_x, need_xc | ^ note: ‘need_xc’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/atom_electronic_structure.F:664:13: 664 | IF (need_x) THEN | ^ Warning: ‘need_x’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/atom_electronic_structure.F:454:66: 454 | need_x, need_xc | ^ note: ‘need_x’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/atom_electronic_structure.F:342:13: 342 | IF (need_xc) THEN | ^ Warning: ‘need_xc’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/atom_electronic_structure.F:137:75: 137 | need_x, need_xc, need_zmp | ^ note: ‘need_xc’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/atom_electronic_structure.F:322:13: 322 | IF (need_x) THEN | ^ Warning: ‘need_x’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/atom_electronic_structure.F:137:66: 137 | need_x, need_xc, need_zmp | ^ note: ‘need_x’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'atom_electronic_structure.mod' due to: atom_electronic_structure.o /build/cp2k-Q381vr/cp2k-8.1/src/atom_electronic_structure.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod base_hooks.mod kinds.mod atom_xc.mod atom_output.mod atom_utils.mod input_constants.mod atom_optimization.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'dkh_main.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/dkh_main.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_fm_struct.mod physcon.mod cp_blacs_env.mod cp_fm_diag.mod cp_fm_basic_linalg.mod cp_fm_cholesky.mod cp_gemm_interface.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/dkh_main.F dkh_main.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:11:39 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dkh_main.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dkh_main.F90 /build/cp2k-Q381vr/cp2k-8.1/src/dkh_main.F:101:37: 101 | SUBROUTINE DKH_full_transformation(qs_env, matrix_s, matrix_v, matrix_t, matrix_pVp, n, dkh_order) | ^ Warning: ‘dkh_full_transformation’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/dkh_main.F:746:20: 746 | SUBROUTINE even4a(n, ev4, e1, pe1p, vv, gg) | ^ Warning: ‘even4a’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'dkh_main.mod' due to: dkh_main.o /build/cp2k-Q381vr/cp2k-8.1/src/dkh_main.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_fm_struct.mod physcon.mod cp_blacs_env.mod cp_fm_diag.mod cp_fm_basic_linalg.mod cp_fm_cholesky.mod cp_gemm_interface.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'atom_operators.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/atom_operators.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atom_types.mod base_hooks.mod kinds.mod mathlib.mod mathconstants.mod lapack.mod physcon.mod dkh_main.mod atom_utils.mod ai_onecenter.mod input_constants.mod periodic_table.mod qs_grid_atom.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/atom_operators.F atom_operators.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:11:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_operators.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_operators.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'atom_operators.mod' due to: atom_operators.o /build/cp2k-Q381vr/cp2k-8.1/src/atom_operators.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atom_types.mod base_hooks.mod kinds.mod mathlib.mod mathconstants.mod lapack.mod physcon.mod dkh_main.mod atom_utils.mod ai_onecenter.mod input_constants.mod periodic_table.mod qs_grid_atom.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'atom_fit.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/atom_fit.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod base_hooks.mod kinds.mod input_constants.mod atom_electronic_structure.mod mathconstants.mod lapack.mod atom_operators.mod physcon.mod powell.mod atom_output.mod atom_utils.mod cp_files.mod periodic_table.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/atom_fit.F atom_fit.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:12:07 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_fit.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_fit.F90 /build/cp2k-Q381vr/cp2k-8.1/src/atom_fit.F:1855:21: 1855 | END FUNCTION rcpro | ^ Warning: ‘yval’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/atom_fit.F:1838:40: 1838 | FUNCTION rcpro(id, xval) RESULT(yval) | ^ note: ‘yval’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/atom_fit.F:182:64: 182 | INTEGER, ALLOCATABLE, DIMENSION(:, :) :: xtob | ^ Warning: ‘xtob.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'atom_fit.mod' due to: atom_fit.o /build/cp2k-Q381vr/cp2k-8.1/src/atom_fit.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod base_hooks.mod kinds.mod input_constants.mod atom_electronic_structure.mod mathconstants.mod lapack.mod atom_operators.mod physcon.mod powell.mod atom_output.mod atom_utils.mod cp_files.mod periodic_table.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'atom_kind_orbitals.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/atom_kind_orbitals.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod basis_set_types.mod rel_control_types.mod atom_types.mod input_section_types.mod external_potential_types.mod atom_utils.mod input_constants.mod kinds.mod atom_fit.mod atom_operators.mod periodic_table.mod base_hooks.mod atom_electronic_structure.mod mathconstants.mod physcon.mod ai_onecenter.mod qs_grid_atom.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/atom_kind_orbitals.F atom_kind_orbitals.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:12:21 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_kind_orbitals.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_kind_orbitals.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'atom_kind_orbitals.mod' due to: atom_kind_orbitals.o /build/cp2k-Q381vr/cp2k-8.1/src/atom_kind_orbitals.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod basis_set_types.mod rel_control_types.mod atom_types.mod input_section_types.mod external_potential_types.mod atom_utils.mod input_constants.mod kinds.mod atom_fit.mod atom_operators.mod periodic_table.mod base_hooks.mod atom_electronic_structure.mod mathconstants.mod physcon.mod ai_onecenter.mod qs_grid_atom.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'hirshfeld_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/hirshfeld_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hirshfeld_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_control_types.mod realspace_grid_types.mod qs_rho_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_methods.mod input_constants.mod kinds.mod periodic_table.mod atom_kind_orbitals.mod base_hooks.mod mathconstants.mod ao_util.mod cp_units.mod cube_utils.mod message_passing.mod grid_api.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/hirshfeld_methods.F hirshfeld_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:12:30 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hirshfeld_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hirshfeld_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'hirshfeld_methods.mod' due to: hirshfeld_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/hirshfeld_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hirshfeld_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_control_types.mod realspace_grid_types.mod qs_rho_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_methods.mod input_constants.mod kinds.mod periodic_table.mod atom_kind_orbitals.mod base_hooks.mod mathconstants.mod ao_util.mod cp_units.mod cube_utils.mod message_passing.mod grid_api.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_cdft_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_cdft_types.mod hirshfeld_types.mod qs_kind_types.mod atomic_kind_types.mod outer_scf_control_types.mod cell_types.mod pw_types.mod cp_control_types.mod realspace_grid_types.mod qs_subsys_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod particle_list_types.mod qs_scf_output.mod input_constants.mod cp_realspace_grid_cube.mod kinds.mod bibliography.mod cp_output_handling.mod base_hooks.mod hirshfeld_methods.mod ao_util.mod cp_units.mod cp_log_handling.mod memory_utilities.mod grid_api.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_utils.F qs_cdft_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:12:35 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_cdft_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_cdft_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_utils.F:925:54: 925 | nzeroed_inner = nzeroed_inner + 1 | ^ Warning: ‘nzeroed_inner’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_utils.F:935:48: 935 | nzeroed = nzeroed + nzeroed_inner | ^ Warning: ‘nzeroed’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_cdft_utils.mod' due to: qs_cdft_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_cdft_types.mod hirshfeld_types.mod qs_kind_types.mod atomic_kind_types.mod outer_scf_control_types.mod cell_types.mod pw_types.mod cp_control_types.mod realspace_grid_types.mod qs_subsys_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod particle_list_types.mod qs_scf_output.mod input_constants.mod cp_realspace_grid_cube.mod kinds.mod bibliography.mod cp_output_handling.mod base_hooks.mod hirshfeld_methods.mod ao_util.mod cp_units.mod cp_log_handling.mod memory_utilities.mod grid_api.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_cdft_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_cdft_types.mod hirshfeld_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod qs_force_types.mod cp_control_types.mod realspace_grid_types.mod qs_energy_types.mod qs_rho_types.mod qs_subsys_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_rho0_types.mod pw_env_types.mod pw_methods.mod input_constants.mod cp_realspace_grid_cube.mod kinds.mod cp_output_handling.mod qs_cdft_utils.mod base_hooks.mod ao_util.mod cp_log_handling.mod kahan_sum.mod cube_utils.mod message_passing.mod grid_api.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_methods.F qs_cdft_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:12:41 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_cdft_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_cdft_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_methods.F:916:122: 916 | gapw_offset(igroup, i) = gapw_offset(igroup, i) + sign*group(igroup)%coeff(iatom)*mp_rho(jatom)%q0(i) | ^ Warning: ‘sign’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_methods.F:791:66: 791 | TYPE(pw_p_type), DIMENSION(:), POINTER :: charge, rho_r | ^ Warning: ‘charge.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_methods.F:791:66: Warning: ‘charge.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_methods.F:161:68: 161 | REAL(kind=dp), ALLOCATABLE, DIMENSION(:, :, :) :: dP_i_dRj | ^ Warning: ‘dp_i_drj.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_methods.F:161:68: Warning: ‘dp_i_drj.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_methods.F:315:35: 315 | dP_i_dRi = 0.0_dp | ^ Warning: ‘dp_i_dri.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_methods.F:311:38: 311 | d_sum_Pm_dR = 0.0_dp | ^ Warning: ‘d_sum_pm_dr.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_methods.F:154:73: 154 | LOGICAL, ALLOCATABLE, DIMENSION(:, :) :: atom_in_group | ^ Warning: ‘atom_in_group.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_methods.F:154:73: Warning: ‘atom_in_group.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_methods.F:471:115: 471 | group(igroup)%coeff(ip)*dP_i_dRi(:, iatom) | ^ Warning: ‘ip’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_methods.F:172:66: 172 | TYPE(pw_p_type), DIMENSION(:), POINTER :: charge | ^ Warning: ‘charge.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_methods.F:172:66: Warning: ‘charge.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_methods.F:724:98: 724 | rho_r(ispin)%pw%cr3d(k, j, i)*dvol | ^ Warning: ‘sign’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_cdft_methods.mod' due to: qs_cdft_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_cdft_types.mod hirshfeld_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod qs_force_types.mod cp_control_types.mod realspace_grid_types.mod qs_energy_types.mod qs_rho_types.mod qs_subsys_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_rho0_types.mod pw_env_types.mod pw_methods.mod input_constants.mod cp_realspace_grid_cube.mod kinds.mod cp_output_handling.mod qs_cdft_utils.mod base_hooks.mod ao_util.mod cp_log_handling.mod kahan_sum.mod cube_utils.mod message_passing.mod grid_api.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_ks_apply_restraints.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_apply_restraints.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_cdft_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod qs_energy_types.mod qs_rho_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod s_square_methods.mod pw_methods.mod mulliken.mod input_constants.mod kinds.mod base_hooks.mod qs_cdft_methods.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_apply_restraints.F qs_ks_apply_restraints.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:12:52 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ks_apply_restraints.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ks_apply_restraints.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_ks_apply_restraints.mod' due to: qs_ks_apply_restraints.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_apply_restraints.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_cdft_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod qs_energy_types.mod qs_rho_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod s_square_methods.mod pw_methods.mod mulliken.mod input_constants.mod kinds.mod base_hooks.mod qs_cdft_methods.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_ks_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_cdft_types.mod pw_grid_types.mod admm_types.mod qs_kind_types.mod qs_ks_types.mod lri_environment_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod qs_force_types.mod cp_control_types.mod qs_charges_types.mod virial_types.mod ps_implicit_types.mod qs_energy_types.mod kpoint_types.mod qs_rho_types.mod task_list_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_poisson_types.mod cp_fm_struct.mod qs_ks_qmmm_methods.mod pw_methods.mod input_constants.mod pw_poisson_methods.mod cp_ddapc.mod lri_environment_methods.mod qs_integrate_potential.mod lri_forces.mod kinds.mod cp_output_handling.mod qs_collocate_density.mod base_hooks.mod xc.mod cp_log_handling.mod kahan_sum.mod lri_ks_methods.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_utils.F qs_ks_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:12:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ks_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ks_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_utils.F:1344:77: 1344 | cdft_control%strength(igroup) | ^ Warning: ‘sign’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_utils.F:801:57: 801 | energy%hartree = energy%hartree + full_scaling*ener | ^ Warning: ‘full_scaling’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_utils.F:797:56: 797 | full_scaling = -dft_control%sic_scaling_a*nelec | ^ Warning: ‘nelec’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_ks_utils.mod' due to: qs_ks_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_cdft_types.mod pw_grid_types.mod admm_types.mod qs_kind_types.mod qs_ks_types.mod lri_environment_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod qs_force_types.mod cp_control_types.mod qs_charges_types.mod virial_types.mod ps_implicit_types.mod qs_energy_types.mod kpoint_types.mod qs_rho_types.mod task_list_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_poisson_types.mod cp_fm_struct.mod qs_ks_qmmm_methods.mod pw_methods.mod input_constants.mod pw_poisson_methods.mod cp_ddapc.mod lri_environment_methods.mod qs_integrate_potential.mod lri_forces.mod kinds.mod cp_output_handling.mod qs_collocate_density.mod base_hooks.mod xc.mod cp_log_handling.mod kahan_sum.mod lri_ks_methods.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'surface_dipole.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/surface_dipole.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod pw_grid_types.mod qs_environment_types.mod pw_pool_types.mod qs_rho_types.mod cp_control_types.mod qs_subsys_types.mod pw_env_types.mod cell_types.mod pw_types.mod base_hooks.mod kinds.mod kahan_sum.mod mathconstants.mod physcon.mod pw_methods.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/surface_dipole.F surface_dipole.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:13:07 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"surface_dipole.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' surface_dipole.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'surface_dipole.mod' due to: surface_dipole.o /build/cp2k-Q381vr/cp2k-8.1/src/surface_dipole.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod pw_grid_types.mod qs_environment_types.mod pw_pool_types.mod qs_rho_types.mod cp_control_types.mod qs_subsys_types.mod pw_env_types.mod cell_types.mod pw_types.mod base_hooks.mod kinds.mod kahan_sum.mod mathconstants.mod physcon.mod pw_methods.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_ks_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_cdft_types.mod qs_local_rho_types.mod admm_types.mod qs_ks_types.mod lri_environment_types.mod cell_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod qs_charges_types.mod virial_types.mod qs_energy_types.mod qs_rho_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_poisson_types.mod hartree_local_types.mod mathlib.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod qs_ks_qmmm_methods.mod pw_methods.mod se_fock_matrix.mod input_constants.mod pw_poisson_methods.mod cp_ddapc.mod lri_environment_methods.mod qs_integrate_potential.mod qs_vxc_atom.mod xtb_matrices.mod kinds.mod admm_dm_methods.mod cp_blacs_env.mod hartree_local_methods.mod qmmm_image_charge.mod cp_output_handling.mod efield_utils.mod qs_ks_atom.mod base_hooks.mod admm_methods.mod qs_efield_local.mod kg_correction.mod rtp_admm_methods.mod qs_sccs.mod cp_fm_basic_linalg.mod qs_gapw_densities.mod qs_efield_berry.mod cp_gemm_interface.mod qs_dftb_matrices.mod qs_core_energies.mod qs_vxc.mod cp_log_handling.mod hfx_admm_utils.mod dft_plus_u.mod qs_rho0_ggrid.mod message_passing.mod qs_ks_apply_restraints.mod qs_ks_utils.mod cp_dbcsr_operations.mod surface_dipole.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_methods.F qs_ks_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:13:10 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ks_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ks_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_ks_methods.mod' due to: qs_ks_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_ks_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_cdft_types.mod qs_local_rho_types.mod admm_types.mod qs_ks_types.mod lri_environment_types.mod cell_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod qs_charges_types.mod virial_types.mod qs_energy_types.mod qs_rho_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_poisson_types.mod hartree_local_types.mod mathlib.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod qs_ks_qmmm_methods.mod pw_methods.mod se_fock_matrix.mod input_constants.mod pw_poisson_methods.mod cp_ddapc.mod lri_environment_methods.mod qs_integrate_potential.mod qs_vxc_atom.mod xtb_matrices.mod kinds.mod admm_dm_methods.mod cp_blacs_env.mod hartree_local_methods.mod qmmm_image_charge.mod cp_output_handling.mod efield_utils.mod qs_ks_atom.mod base_hooks.mod admm_methods.mod qs_efield_local.mod kg_correction.mod rtp_admm_methods.mod qs_sccs.mod cp_fm_basic_linalg.mod qs_gapw_densities.mod qs_efield_berry.mod cp_gemm_interface.mod qs_dftb_matrices.mod qs_core_energies.mod qs_vxc.mod cp_log_handling.mod hfx_admm_utils.mod dft_plus_u.mod qs_rho0_ggrid.mod message_passing.mod qs_ks_apply_restraints.mod qs_ks_utils.mod cp_dbcsr_operations.mod surface_dipole.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_electric_field_gradient.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_electric_field_gradient.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod pw_types.mod basis_set_types.mod cp_control_types.mod qs_rho_types.mod qs_rho_atom_types.mod particle_types.mod paw_proj_set_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_poisson_types.mod pw_methods.mod pw_poisson_methods.mod kinds.mod cp_output_handling.mod base_hooks.mod util.mod mathconstants.mod physcon.mod eigenvalueproblems.mod qs_gapw_densities.mod qs_harmonics_atom.mod cp_log_handling.mod qs_ks_methods.mod orbital_pointers.mod message_passing.mod pw_spline_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_electric_field_gradient.F qs_electric_field_gradient.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:13:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_electric_field_gradient.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_electric_field_gradient.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_electric_field_gradient.F:106:66: 106 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :) :: efg_pw, efg_tensor | ^ Warning: ‘efg_pw.dim[2].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_electric_field_gradient.mod' due to: qs_electric_field_gradient.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_electric_field_gradient.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod pw_types.mod basis_set_types.mod cp_control_types.mod qs_rho_types.mod qs_rho_atom_types.mod particle_types.mod paw_proj_set_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_poisson_types.mod pw_methods.mod pw_poisson_methods.mod kinds.mod cp_output_handling.mod base_hooks.mod util.mod mathconstants.mod physcon.mod eigenvalueproblems.mod qs_gapw_densities.mod qs_harmonics_atom.mod cp_log_handling.mod qs_ks_methods.mod orbital_pointers.mod message_passing.mod pw_spline_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_energy_window.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy_window.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod pw_types.mod cp_fm_types.mod qs_rho_types.mod qs_subsys_types.mod input_section_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod particle_list_types.mod cp_fm_struct.mod cp_fm_diag.mod pw_methods.mod cp_realspace_grid_cube.mod kinds.mod cp_dbcsr_operations.mod cp_blacs_env.mod cp_output_handling.mod qs_collocate_density.mod base_hooks.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_log_handling.mod iterate_matrix.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy_window.F qs_energy_window.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:13:28 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_energy_window.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_energy_window.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy_window.F:142:15: 142 | stride = section_get_ivals(dft_section, "PRINT%ENERGY_WINDOWS%STRIDE") | 1 Warning: POINTER-valued function appears on right-hand side of assignment at (1) [-Wsurprising] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_energy_window.mod' due to: qs_energy_window.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy_window.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod pw_types.mod cp_fm_types.mod qs_rho_types.mod qs_subsys_types.mod input_section_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod particle_list_types.mod cp_fm_struct.mod cp_fm_diag.mod pw_methods.mod cp_realspace_grid_cube.mod kinds.mod cp_dbcsr_operations.mod cp_blacs_env.mod cp_output_handling.mod qs_collocate_density.mod base_hooks.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_log_handling.mod iterate_matrix.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'voronoi_interface.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/voronoi_interface.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_control_types.mod qs_rho_types.mod qs_subsys_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod particle_list_types.mod input_constants.mod kinds.mod bibliography.mod base_hooks.mod physcon.mod cp_log_handling.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/voronoi_interface.F voronoi_interface.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:13:31 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"voronoi_interface.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' voronoi_interface.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'voronoi_interface.mod' due to: voronoi_interface.o /build/cp2k-Q381vr/cp2k-8.1/src/voronoi_interface.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_control_types.mod qs_rho_types.mod qs_subsys_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod particle_list_types.mod input_constants.mod kinds.mod bibliography.mod base_hooks.mod physcon.mod cp_log_handling.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pw_env_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pw_env_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod qs_kind_types.mod ps_wavelet_types.mod cell_types.mod dielectric_types.mod basis_set_types.mod cp_control_types.mod ps_implicit_types.mod realspace_grid_types.mod qs_dispersion_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_rho0_types.mod pw_env_types.mod pw_poisson_types.mod input_constants.mod pw_poisson_methods.mod xc_input_constants.mod kinds.mod cp_output_handling.mod pw_grid_info.mod d3_poly.mod base_hooks.mod dct.mod pw_poisson_read_input.mod ao_util.mod cp_log_handling.mod gaussian_gridlevels.mod cube_utils.mod cp_realspace_grid_init.mod pw_grids.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pw_env_methods.F pw_env_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:13:33 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw_env_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_env_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/pw_env_methods.F:1028:45: 1028 | 1, (/-1, -1, -1/)) | ^ Warning: ‘border_points’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw_env_methods.F:797:16: 797 | IF (igrid_zet0_s == igrid_level) maxradius = MAX(maxradius, max_rpgf0_s) | ^ Warning: ‘igrid_zet0_s’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pw_env_methods.F:751:67: 751 | INTEGER :: handle, ibasis_set_type, igrid_level, igrid_zet0_s, ikind, ipgf, iset, ishell, & | ^ note: ‘igrid_zet0_s’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pw_env_methods.mod' due to: pw_env_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/pw_env_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod qs_kind_types.mod ps_wavelet_types.mod cell_types.mod dielectric_types.mod basis_set_types.mod cp_control_types.mod ps_implicit_types.mod realspace_grid_types.mod qs_dispersion_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_rho0_types.mod pw_env_types.mod pw_poisson_types.mod input_constants.mod pw_poisson_methods.mod xc_input_constants.mod kinds.mod cp_output_handling.mod pw_grid_info.mod d3_poly.mod base_hooks.mod dct.mod pw_poisson_read_input.mod ao_util.mod cp_log_handling.mod gaussian_gridlevels.mod cube_utils.mod cp_realspace_grid_init.mod pw_grids.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_active_space_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod qs_active_space_types.mod qs_energy_types.mod qs_rho_types.mod task_list_types.mod qs_subsys_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_loc_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_poisson_types.mod particle_list_types.mod cp_fm_struct.mod cp_fm_diag.mod pw_env_methods.mod qs_loc_utils.mod pw_methods.mod qs_mo_methods.mod input_constants.mod cp_fm_vect.mod pw_poisson_methods.mod cp_realspace_grid_cube.mod kinds.mod cp_output_handling.mod periodic_table.mod qs_collocate_density.mod base_hooks.mod mathconstants.mod qs_loc_methods.mod cp_fm_basic_linalg.mod cp_files.mod cp_gemm_interface.mod task_list_methods.mod cp_log_handling.mod qs_ks_methods.mod memory_utilities.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_methods.F qs_active_space_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:13:36 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_active_space_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_active_space_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_methods.F:1179:82: 1179 | wfn_r%pw%cr3d = rho_r%pw%cr3d*wfn3%pw%cr3d*wfn4%pw%cr3d | ^ Warning: ‘wfn4’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_methods.F:981:82: 981 | TYPE(pw_p_type), POINTER :: wfn1, wfn2, wfn3, wfn4 | ^ note: ‘wfn4’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_methods.F:1179:82: 1179 | wfn_r%pw%cr3d = rho_r%pw%cr3d*wfn3%pw%cr3d*wfn4%pw%cr3d | ^ Warning: ‘wfn3’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_methods.F:981:76: 981 | TYPE(pw_p_type), POINTER :: wfn1, wfn2, wfn3, wfn4 | ^ note: ‘wfn3’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_methods.F:1142:56: 1142 | rho_r%pw%cr3d = wfn1%pw%cr3d*wfn2%pw%cr3d | ^ Warning: ‘wfn2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_methods.F:981:70: 981 | TYPE(pw_p_type), POINTER :: wfn1, wfn2, wfn3, wfn4 | ^ note: ‘wfn2’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_methods.F:1142:56: 1142 | rho_r%pw%cr3d = wfn1%pw%cr3d*wfn2%pw%cr3d | ^ Warning: ‘wfn1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_methods.F:981:64: 981 | TYPE(pw_p_type), POINTER :: wfn1, wfn2, wfn3, wfn4 | ^ note: ‘wfn1’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_methods.F:980:65: 980 | TYPE(pw_p_type), DIMENSION(:, :), POINTER :: wfn_a | ^ Warning: ‘wfn_a.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_methods.F:980:65: Warning: ‘wfn_a.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_methods.F:980:65: Warning: ‘wfn_a.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_methods.F:1100:31: 1100 | IF (print2 .AND. iw > 0) THEN | ^ Warning: ‘print2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_methods.F:965:74: 965 | LOGICAL :: print1, print2, & | ^ note: ‘print2’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_methods.F:1205:22: 1205 | IF (print1 .AND. iw > 0) THEN | ^ Warning: ‘print1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_methods.F:965:66: 965 | LOGICAL :: print1, print2, & | ^ note: ‘print1’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_methods.F:1996:65: 1996 | ALLOCATE (nq(ishell), lq(ishell), zet(ishell), sym(ishell)) | ^ Warning: ‘ishell’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_methods.F:187:78: 187 | INTEGER :: eri_method, eri_operator, eri_print, handle, i, iatom, ishell, isp, ispin, iw, j, & | ^ note: ‘ishell’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_active_space_methods.mod' due to: qs_active_space_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_active_space_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod qs_active_space_types.mod qs_energy_types.mod qs_rho_types.mod task_list_types.mod qs_subsys_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_loc_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_poisson_types.mod particle_list_types.mod cp_fm_struct.mod cp_fm_diag.mod pw_env_methods.mod qs_loc_utils.mod pw_methods.mod qs_mo_methods.mod input_constants.mod cp_fm_vect.mod pw_poisson_methods.mod cp_realspace_grid_cube.mod kinds.mod cp_output_handling.mod periodic_table.mod qs_collocate_density.mod base_hooks.mod mathconstants.mod qs_loc_methods.mod cp_fm_basic_linalg.mod cp_files.mod cp_gemm_interface.mod task_list_methods.mod cp_log_handling.mod qs_ks_methods.mod memory_utilities.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_dos.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_dos.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod qs_environment_types.mod cp_control_types.mod qs_mo_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_output_handling.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_dos.F qs_dos.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:13:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dos.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dos.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_dos.F:139:28: 139 | nhist = MAXVAL(nmo) | ^ Warning: ‘nmo[0]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_dos.F:139:28: Warning: ‘nmo[1]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_dos.mod' due to: qs_dos.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_dos.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod qs_environment_types.mod cp_control_types.mod qs_mo_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_output_handling.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'uff_vdw_radii_table.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/uff_vdw_radii_table.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/uff_vdw_radii_table.F uff_vdw_radii_table.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:13:52 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"uff_vdw_radii_table.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' uff_vdw_radii_table.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'uff_vdw_radii_table.mod' due to: uff_vdw_radii_table.o /build/cp2k-Q381vr/cp2k-8.1/src/uff_vdw_radii_table.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_resp.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_resp.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_control_types.mod qs_subsys_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_poisson_types.mod particle_list_types.mod pw_methods.mod input_constants.mod pw_poisson_methods.mod cp_realspace_grid_cube.mod kinds.mod uff_vdw_radii_table.mod atomic_charges.mod bibliography.mod cp_output_handling.mod periodic_table.mod qs_collocate_density.mod base_hooks.mod mathconstants.mod machine.mod cp_units.mod cp_log_handling.mod kahan_sum.mod memory_utilities.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_resp.F qs_resp.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:13:53 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_resp.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_resp.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_resp.F:1111:25: 1111 | IF (dist(m) < rmin + delta) not_in_range(m, 1) = .TRUE. | ^ Warning: ‘rmin’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_resp.F:1048:93: 1048 | REAL(KIND=dp) :: delta, dh(3, 3), r(3), rmax, rmin, & | ^ note: ‘rmin’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/qs_resp.F:1112:25: 1112 | IF (dist(m) > rmax - delta) not_in_range(m, 2) = .TRUE. | ^ Warning: ‘rmax’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_resp.F:1048:87: 1048 | REAL(KIND=dp) :: delta, dh(3, 3), r(3), rmax, rmin, & | ^ note: ‘rmax’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/qs_resp.F:1150:22: 1150 | IF (in_z*in_y*in_x == 0) CYCLE | ^ Warning: ‘in_z’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_resp.F:1044:83: 1044 | ikind, in_x, in_y, in_z, jx, jy, jz, & | ^ note: ‘in_z’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/qs_resp.F:1150:22: 1150 | IF (in_z*in_y*in_x == 0) CYCLE | ^ Warning: ‘in_y’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_resp.F:1044:77: 1044 | ikind, in_x, in_y, in_z, jx, jy, jz, & | ^ note: ‘in_y’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/qs_resp.F:1150:22: 1150 | IF (in_z*in_y*in_x == 0) CYCLE | ^ Warning: ‘in_x’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_resp.F:1044:71: 1044 | ikind, in_x, in_y, in_z, jx, jy, jz, & | ^ note: ‘in_x’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/qs_resp.F:858:16: 858 | IF (dist(i) < rmin + delta) not_in_range(i, 1) = .TRUE. | ^ Warning: ‘rmin’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_resp.F:777:99: 777 | REAL(KIND=dp) :: delta, dh(3, 3), dvol, r(3), rmax, rmin, & | ^ note: ‘rmin’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/qs_resp.F:859:16: 859 | IF (dist(i) > rmax - delta) not_in_range(i, 2) = .TRUE. | ^ Warning: ‘rmax’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_resp.F:777:93: 777 | REAL(KIND=dp) :: delta, dh(3, 3), dvol, r(3), rmax, rmin, & | ^ note: ‘rmax’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_resp.mod' due to: qs_resp.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_resp.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_control_types.mod qs_subsys_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_poisson_types.mod particle_list_types.mod pw_methods.mod input_constants.mod pw_poisson_methods.mod cp_realspace_grid_cube.mod kinds.mod uff_vdw_radii_table.mod atomic_charges.mod bibliography.mod cp_output_handling.mod periodic_table.mod qs_collocate_density.mod base_hooks.mod mathconstants.mod machine.mod cp_units.mod cp_log_handling.mod kahan_sum.mod memory_utilities.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'population_analyses.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/population_analyses.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cp_fm_types.mod basis_set_types.mod qs_rho_types.mod particle_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod cp_fm_struct.mod cp_fm_diag.mod cp_dbcsr_output.mod particle_methods.mod kinds.mod cp_blacs_env.mod base_hooks.mod machine.mod cp_gemm_interface.mod orbital_pointers.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/population_analyses.F population_analyses.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:14:00 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"population_analyses.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' population_analyses.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'population_analyses.mod' due to: population_analyses.o /build/cp2k-Q381vr/cp2k-8.1/src/population_analyses.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cp_fm_types.mod basis_set_types.mod qs_rho_types.mod particle_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod cp_fm_struct.mod cp_fm_diag.mod cp_dbcsr_output.mod particle_methods.mod kinds.mod cp_blacs_env.mod base_hooks.mod machine.mod cp_gemm_interface.mod orbital_pointers.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_elf_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_elf_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_rho_types.mod pw_pool_types.mod pw_env_types.mod qs_ks_types.mod pw_types.mod base_hooks.mod kinds.mod mathconstants.mod pw_methods.mod qs_collocate_density.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_elf_methods.F qs_elf_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:14:04 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_elf_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_elf_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_elf_methods.mod' due to: qs_elf_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_elf_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_rho_types.mod pw_pool_types.mod pw_env_types.mod qs_ks_types.mod pw_types.mod base_hooks.mod kinds.mod mathconstants.mod pw_methods.mod qs_collocate_density.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_ot.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_ot.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ot_types.mod preconditioner_types.mod base_hooks.mod kinds.mod preconditioner.mod arnoldi_api.mod message_passing.mod cp_dbcsr_cholesky.mod cp_dbcsr_diag.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_ot.F qs_ot.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:14:06 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ot.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ot.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_ot.mod' due to: qs_ot.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_ot.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ot_types.mod preconditioner_types.mod base_hooks.mod kinds.mod preconditioner.mod arnoldi_api.mod message_passing.mod cp_dbcsr_cholesky.mod cp_dbcsr_diag.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_ot_minimizer.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_ot_minimizer.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ot_types.mod base_hooks.mod cp_log_handling.mod preconditioner.mod mathlib.mod kinds.mod qs_ot.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_ot_minimizer.F qs_ot_minimizer.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:14:09 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ot_minimizer.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ot_minimizer.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_ot_minimizer.mod' due to: qs_ot_minimizer.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_ot_minimizer.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ot_types.mod base_hooks.mod cp_log_handling.mod preconditioner.mod mathlib.mod kinds.mod qs_ot.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_ot_eigensolver.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_ot_eigensolver.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ot_types.mod preconditioner_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod qs_ot_minimizer.mod qs_mo_methods.mod cp_dbcsr_cholesky.mod cp_dbcsr_operations.mod qs_ot.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_ot_eigensolver.F qs_ot_eigensolver.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:14:17 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ot_eigensolver.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ot_eigensolver.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_ot_eigensolver.mod' due to: qs_ot_eigensolver.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_ot_eigensolver.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ot_types.mod preconditioner_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod qs_ot_minimizer.mod qs_mo_methods.mod cp_dbcsr_cholesky.mod cp_dbcsr_operations.mod qs_ot.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_loc_dipole.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_dipole.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_loc_types.mod qs_environment_types.mod cp_result_types.mod cp_control_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod moments_utils.mod mathconstants.mod physcon.mod cp_output_handling.mod cp_result_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_dipole.F qs_loc_dipole.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:14:19 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_loc_dipole.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_loc_dipole.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_loc_dipole.mod' due to: qs_loc_dipole.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_dipole.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_loc_types.mod qs_environment_types.mod cp_result_types.mod cp_control_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod moments_utils.mod mathconstants.mod physcon.mod cp_output_handling.mod cp_result_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'molecular_moments.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/molecular_moments.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod particle_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod qs_loc_types.mod qs_environment_types.mod distribution_1d_types.mod moments_utils.mod cp_fm_struct.mod qs_moments.mod input_constants.mod kinds.mod cp_output_handling.mod base_hooks.mod cp_fm_basic_linalg.mod cp_log_handling.mod orbital_pointers.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/molecular_moments.F molecular_moments.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:14:21 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"molecular_moments.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molecular_moments.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'molecular_moments.mod' due to: molecular_moments.o /build/cp2k-Q381vr/cp2k-8.1/src/molecular_moments.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod particle_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod qs_loc_types.mod qs_environment_types.mod distribution_1d_types.mod moments_utils.mod cp_fm_struct.mod qs_moments.mod input_constants.mod kinds.mod cp_output_handling.mod base_hooks.mod cp_fm_basic_linalg.mod cp_log_handling.mod orbital_pointers.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'molecular_dipoles.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/molecular_dipoles.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod cp_control_types.mod particle_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod qs_loc_types.mod qs_environment_types.mod distribution_1d_types.mod moments_utils.mod kinds.mod cp_output_handling.mod base_hooks.mod mathconstants.mod physcon.mod cp_log_handling.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/molecular_dipoles.F molecular_dipoles.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:14:24 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"molecular_dipoles.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molecular_dipoles.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'molecular_dipoles.mod' due to: molecular_dipoles.o /build/cp2k-Q381vr/cp2k-8.1/src/molecular_dipoles.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod cp_control_types.mod particle_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod qs_loc_types.mod qs_environment_types.mod distribution_1d_types.mod moments_utils.mod kinds.mod cp_output_handling.mod base_hooks.mod mathconstants.mod physcon.mod cp_log_handling.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_loc_molecules.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_molecules.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_loc_types.mod distribution_1d_types.mod particle_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod base_hooks.mod kinds.mod cp_log_handling.mod memory_utilities.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_molecules.F qs_loc_molecules.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:14:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_loc_molecules.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_loc_molecules.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_molecules.F:172:60: 172 | i = molecule_set(imol_now)%lmi(ispin)%nstates | ^ Warning: ‘imol_now’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_loc_molecules.mod' due to: qs_loc_molecules.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_molecules.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_loc_types.mod distribution_1d_types.mod particle_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod base_hooks.mod kinds.mod cp_log_handling.mod memory_utilities.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'molecular_states.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/molecular_states.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod particle_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_env_types.mod particle_list_types.mod cp_fm_struct.mod cp_fm_diag.mod cp_realspace_grid_cube.mod kinds.mod cp_dbcsr_operations.mod bibliography.mod cp_output_handling.mod qs_collocate_density.mod base_hooks.mod cp_gemm_interface.mod cp_log_handling.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/molecular_states.F molecular_states.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:14:28 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"molecular_states.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molecular_states.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'molecular_states.mod' due to: molecular_states.o /build/cp2k-Q381vr/cp2k-8.1/src/molecular_states.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod particle_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_env_types.mod particle_list_types.mod cp_fm_struct.mod cp_fm_diag.mod cp_realspace_grid_cube.mod kinds.mod cp_dbcsr_operations.mod bibliography.mod cp_output_handling.mod qs_collocate_density.mod base_hooks.mod cp_gemm_interface.mod cp_log_handling.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'wannier_states.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/wannier_states.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod wannier_states_types.mod input_section_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_fm_struct.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_units.mod cp_gemm_interface.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/wannier_states.F wannier_states.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:14:32 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"wannier_states.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' wannier_states.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'wannier_states.mod' due to: wannier_states.o /build/cp2k-Q381vr/cp2k-8.1/src/wannier_states.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod wannier_states_types.mod input_section_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_fm_struct.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_units.mod cp_gemm_interface.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_loc_states.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_states.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 wannier_states_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod qs_mo_types.mod molecule_types.mod input_section_types.mod qs_loc_types.mod qs_environment_types.mod particle_list_types.mod cp_array_utils.mod molecular_moments.mod kinds.mod cp_output_handling.mod molecular_dipoles.mod base_hooks.mod qs_loc_methods.mod qs_loc_molecules.mod molecular_states.mod cp_log_handling.mod wannier_states.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_states.F qs_loc_states.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:14:34 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_loc_states.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_loc_states.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_loc_states.mod' due to: qs_loc_states.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_loc_states.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 wannier_states_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod qs_mo_types.mod molecule_types.mod input_section_types.mod qs_loc_types.mod qs_environment_types.mod particle_list_types.mod cp_array_utils.mod molecular_moments.mod kinds.mod cp_output_handling.mod molecular_dipoles.mod base_hooks.mod qs_loc_methods.mod qs_loc_molecules.mod molecular_states.mod cp_log_handling.mod wannier_states.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xray_diffraction.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xray_diffraction.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod basis_set_types.mod cp_control_types.mod qs_rho_types.mod qs_rho_atom_types.mod particle_types.mod paw_proj_set_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_methods.mod kinds.mod bibliography.mod base_hooks.mod util.mod mathconstants.mod physcon.mod memory_utilities.mod orbital_transformation_matrices.mod orbital_pointers.mod message_passing.mod pw_grids.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xray_diffraction.F xray_diffraction.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:14:37 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xray_diffraction.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xray_diffraction.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xray_diffraction.mod' due to: xray_diffraction.o /build/cp2k-Q381vr/cp2k-8.1/src/xray_diffraction.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod basis_set_types.mod cp_control_types.mod qs_rho_types.mod qs_rho_atom_types.mod particle_types.mod paw_proj_set_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_methods.mod kinds.mod bibliography.mod base_hooks.mod util.mod mathconstants.mod physcon.mod memory_utilities.mod orbital_transformation_matrices.mod orbital_pointers.mod message_passing.mod pw_grids.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_epr_hyp.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_epr_hyp.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_control_types.mod qs_rho_types.mod qs_rho_atom_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_methods.mod kinds.mod cp_output_handling.mod periodic_table.mod base_hooks.mod util.mod mathconstants.mod physcon.mod qs_grid_atom.mod qs_harmonics_atom.mod cp_log_handling.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_epr_hyp.F qs_epr_hyp.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:14:42 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_epr_hyp.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_epr_hyp.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_epr_hyp.mod' due to: qs_epr_hyp.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_epr_hyp.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_control_types.mod qs_rho_types.mod qs_rho_atom_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_methods.mod kinds.mod cp_output_handling.mod periodic_table.mod base_hooks.mod util.mod mathconstants.mod physcon.mod qs_grid_atom.mod qs_harmonics_atom.mod cp_log_handling.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_pdos.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_pdos.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod preconditioner_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod cp_fm_struct.mod cp_fm_diag.mod qs_mo_methods.mod kinds.mod cp_blacs_env.mod cp_output_handling.mod qs_collocate_density.mod base_hooks.mod orbital_symbols.mod cp_gemm_interface.mod qs_ot_eigensolver.mod cp_log_handling.mod memory_utilities.mod orbital_pointers.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_pdos.F qs_pdos.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:14:46 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_pdos.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_pdos.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_pdos.F:888:21: 888 | IF (.NOT. read_r(3, ildos)) THEN | ^ Warning: ‘read_r.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_pdos.F:663:95: 663 | r_ldos_p(ildos)%ldos%pdos_array(imo) = r_ldos_p(ildos)%ldos%pdos_array(imo)*dvol | ^ Warning: ‘dvol’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_pdos.mod' due to: qs_pdos.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_pdos.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod preconditioner_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod cp_fm_struct.mod cp_fm_diag.mod qs_mo_methods.mod kinds.mod cp_blacs_env.mod cp_output_handling.mod qs_collocate_density.mod base_hooks.mod orbital_symbols.mod cp_gemm_interface.mod qs_ot_eigensolver.mod cp_log_handling.mod memory_utilities.mod orbital_pointers.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_scf_wfn_mix.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_wfn_mix.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod particle_types.mod qs_kind_types.mod qs_mo_types.mod input_section_types.mod cp_fm_types.mod base_hooks.mod qs_mo_io.mod kinds.mod cp_fm_struct.mod cp_fm_basic_linalg.mod qs_mo_methods.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_wfn_mix.F qs_scf_wfn_mix.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:14:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_wfn_mix.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_wfn_mix.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_scf_wfn_mix.mod' due to: qs_scf_wfn_mix.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_wfn_mix.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod particle_types.mod qs_kind_types.mod qs_mo_types.mod input_section_types.mod cp_fm_types.mod base_hooks.mod qs_mo_io.mod kinds.mod cp_fm_struct.mod cp_fm_basic_linalg.mod qs_mo_methods.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_energy_matrix_w.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy_matrix_w.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 kpoint_types.mod qs_environment_types.mod qs_rho_types.mod scf_control_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_mo_types.mod cp_fm_types.mod base_hooks.mod kinds.mod qs_ks_methods.mod cp_fm_struct.mod kpoint_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy_matrix_w.F qs_energy_matrix_w.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:14:55 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_energy_matrix_w.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_energy_matrix_w.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_energy_matrix_w.mod' due to: qs_energy_matrix_w.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy_matrix_w.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 kpoint_types.mod qs_environment_types.mod qs_rho_types.mod scf_control_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_mo_types.mod cp_fm_types.mod base_hooks.mod kinds.mod qs_ks_methods.mod cp_fm_struct.mod kpoint_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_local_properties.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_local_properties.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod pw_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod qs_rho_types.mod input_section_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod mathlib.mod pw_methods.mod kinds.mod bibliography.mod qs_energy_matrix_w.mod qs_collocate_density.mod base_hooks.mod qs_core_energies.mod qs_vxc.mod cp_log_handling.mod qs_ks_methods.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_local_properties.F qs_local_properties.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:14:58 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_local_properties.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_local_properties.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_local_properties.mod' due to: qs_local_properties.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_local_properties.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod pw_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod qs_rho_types.mod input_section_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod mathlib.mod pw_methods.mod kinds.mod bibliography.mod qs_energy_matrix_w.mod qs_collocate_density.mod base_hooks.mod qs_core_energies.mod qs_vxc.mod cp_log_handling.mod qs_ks_methods.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_wf_history_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_wf_history_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_ks_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod cp_fm_pool_types.mod qs_rho_types.mod qs_mo_types.mod qs_wf_history_types.mod scf_control_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod mathlib.mod cp_fm_struct.mod qs_matrix_pools.mod pw_methods.mod qs_mo_methods.mod input_constants.mod kinds.mod bibliography.mod cp_output_handling.mod qs_rho_methods.mod base_hooks.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_log_handling.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_wf_history_methods.F qs_wf_history_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:15:02 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_wf_history_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_wf_history_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_wf_history_methods.mod' due to: qs_wf_history_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_wf_history_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_ks_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod cp_fm_pool_types.mod qs_rho_types.mod qs_mo_types.mod qs_wf_history_types.mod scf_control_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod mathlib.mod cp_fm_struct.mod qs_matrix_pools.mod pw_methods.mod qs_mo_methods.mod input_constants.mod kinds.mod bibliography.mod cp_output_handling.mod qs_rho_methods.mod base_hooks.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_log_handling.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_scf_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_density_mixing_types.mod qs_mo_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_fm_struct.mod cp_fm_diag.mod cp_fm_basic_linalg.mod message_passing.mod input_constants.mod cp_dbcsr_operations.mod cp_fm_cholesky.mod cp_gemm_interface.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_methods.F qs_scf_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:15:07 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_scf_methods.mod' due to: qs_scf_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_density_mixing_types.mod qs_mo_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_fm_struct.mod cp_fm_diag.mod cp_fm_basic_linalg.mod message_passing.mod input_constants.mod cp_dbcsr_operations.mod cp_fm_cholesky.mod cp_gemm_interface.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_mixing_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_mixing_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod qs_density_mixing_types.mod qs_rho_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_rho_atom_types.mod distribution_1d_types.mod pw_types.mod base_hooks.mod kinds.mod cp_dbcsr_cp2k_link.mod qs_scf_methods.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_mixing_utils.F qs_mixing_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:15:09 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_mixing_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_mixing_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_mixing_utils.F:125:80: 125 | max_shell, na, natom, nbuffer, nel, & | ^ Warning: ‘natom’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_mixing_utils.F:233:39: 233 | mixing_store%ubroy = 0.0_dp | ^ Warning: ‘na’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_mixing_utils.F:229:66: 229 | ALLOCATE (mixing_store%dfbroy(na, max_shell, nbuffer)) | ^ Warning: ‘max_shell’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_mixing_utils.mod' due to: qs_mixing_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_mixing_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod qs_density_mixing_types.mod qs_rho_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_rho_atom_types.mod distribution_1d_types.mod pw_types.mod base_hooks.mod kinds.mod cp_dbcsr_cp2k_link.mod qs_scf_methods.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xas_restart.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xas_restart.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_ks_types.mod cp_fm_types.mod xas_env_types.mod cp_control_types.mod qs_rho_types.mod qs_rho_atom_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod string_utilities.mod qs_mo_methods.mod qs_mo_occupation.mod qs_mo_io.mod kinds.mod cp_output_handling.mod qs_rho_methods.mod base_hooks.mod cp_files.mod cp_gemm_interface.mod cp_log_handling.mod qs_mixing_utils.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xas_restart.F xas_restart.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:15:18 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_restart.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_restart.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xas_restart.mod' due to: xas_restart.o /build/cp2k-Q381vr/cp2k-8.1/src/xas_restart.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_ks_types.mod cp_fm_types.mod xas_env_types.mod cp_control_types.mod qs_rho_types.mod qs_rho_atom_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod string_utilities.mod qs_mo_methods.mod qs_mo_occupation.mod qs_mo_io.mod kinds.mod cp_output_handling.mod qs_rho_methods.mod base_hooks.mod cp_files.mod cp_gemm_interface.mod cp_log_handling.mod qs_mixing_utils.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_scf_lanczos.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_lanczos.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 scf_control_types.mod qs_scf_types.mod qs_mo_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_fm_struct.mod cp_fm_diag.mod cp_fm_basic_linalg.mod message_passing.mod cp_fm_cholesky.mod cp_gemm_interface.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_lanczos.F qs_scf_lanczos.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:15:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_lanczos.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_lanczos.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_scf_lanczos.mod' due to: qs_scf_lanczos.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_lanczos.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 scf_control_types.mod qs_scf_types.mod qs_mo_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_fm_struct.mod cp_fm_diag.mod cp_fm_basic_linalg.mod message_passing.mod cp_fm_cholesky.mod cp_gemm_interface.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_diis.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_diis.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod dm_ls_scf_types.mod qs_environment_types.mod qs_diis_types.mod qs_mo_types.mod input_section_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod cp_fm_struct.mod cp_output_handling.mod cp_fm_basic_linalg.mod string_utilities.mod cp_dbcsr_operations.mod cp_gemm_interface.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_diis.F qs_diis.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:15:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_diis.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_diis.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_diis.mod' due to: qs_diis.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_diis.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod dm_ls_scf_types.mod qs_environment_types.mod qs_diis_types.mod qs_mo_types.mod input_section_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod cp_fm_struct.mod cp_output_handling.mod cp_fm_basic_linalg.mod string_utilities.mod cp_dbcsr_operations.mod cp_gemm_interface.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_gspace_mixing.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_gspace_mixing.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod qs_density_mixing_types.mod qs_rho_types.mod pw_pool_types.mod cp_control_types.mod qs_rho_atom_types.mod pw_env_types.mod pw_types.mod base_hooks.mod kinds.mod mathlib.mod qs_scf_methods.mod pw_methods.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_gspace_mixing.F qs_gspace_mixing.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:15:32 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_gspace_mixing.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_gspace_mixing.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_gspace_mixing.F:713:106: 713 | mixing_store%res_buffer(ib, ispin)%cc(:) = mixing_store%res_buffer(ib, ispin)%cc(:)/delta_norm | ^ Warning: ‘ib’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_gspace_mixing.F:895:96: 895 | COMPLEX(dp), ALLOCATABLE, DIMENSION(:) :: delta_res_p, res_rho, res_rho_p, tmp | ^ Warning: ‘tmp.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_gspace_mixing.F:895:71: 895 | COMPLEX(dp), ALLOCATABLE, DIMENSION(:) :: delta_res_p, res_rho, res_rho_p, tmp | ^ Warning: ‘delta_res_p.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_gspace_mixing.F:903:76: 903 | REAL(dp), ALLOCATABLE, DIMENSION(:, :) :: a, au, av, b, bq, work | ^ Warning: ‘bq.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_gspace_mixing.F:1083:23: 1083 | bq = 0.0_dp | ^ Warning: ‘bq.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_gspace_mixing.F:903:76: 903 | REAL(dp), ALLOCATABLE, DIMENSION(:, :) :: a, au, av, b, bq, work | ^ Warning: ‘bq.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_gspace_mixing.F:897:78: 897 | kb, kkb, lwork, nb, nbuffer, ng, nspin | ^ Warning: ‘nb’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_gspace_mixing.mod' due to: qs_gspace_mixing.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_gspace_mixing.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod qs_density_mixing_types.mod qs_rho_types.mod pw_pool_types.mod cp_control_types.mod qs_rho_atom_types.mod pw_env_types.mod pw_types.mod base_hooks.mod kinds.mod mathlib.mod qs_scf_methods.mod pw_methods.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_scf_block_davidson.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_block_davidson.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_block_davidson_types.mod preconditioner_types.mod qs_mo_types.mod cp_fm_types.mod base_hooks.mod kinds.mod preconditioner.mod cp_fm_struct.mod cp_fm_diag.mod machine.mod cp_fm_basic_linalg.mod message_passing.mod cp_dbcsr_operations.mod cp_fm_cholesky.mod cp_gemm_interface.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_block_davidson.F qs_scf_block_davidson.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:16:49 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_block_davidson.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_block_davidson.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_block_davidson.F:884:43: 884 | i_first = inotconv_set(j, 1) | ^ Warning: ‘inotconv_set.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_block_davidson.F:885:42: 885 | i_last = inotconv_set(j, 2) | ^ Warning: ‘inotconv_set.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_scf_block_davidson.mod' due to: qs_scf_block_davidson.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_block_davidson.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_block_davidson_types.mod preconditioner_types.mod qs_mo_types.mod cp_fm_types.mod base_hooks.mod kinds.mod preconditioner.mod cp_fm_struct.mod cp_fm_diag.mod machine.mod cp_fm_basic_linalg.mod message_passing.mod cp_dbcsr_operations.mod cp_fm_cholesky.mod cp_gemm_interface.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_scf_diagonalization.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_diagonalization.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_ks_types.mod cp_fm_types.mod cp_control_types.mod qs_energy_types.mod kpoint_types.mod cp_fm_pool_types.mod qs_rho_types.mod qs_rho_atom_types.mod cp_cfm_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod qs_density_mixing_types.mod qs_neighbor_list_types.mod preconditioner.mod cp_dbcsr_cp2k_link.mod cp_array_utils.mod cp_fm_struct.mod kpoint_methods.mod qs_diis.mod cp_fm_diag.mod qs_matrix_pools.mod qs_mo_methods.mod input_constants.mod qs_mo_occupation.mod kinds.mod qs_scf_lanczos.mod cp_output_handling.mod qs_rho_methods.mod cp_cfm_basic_linalg.mod base_hooks.mod cp_cfm_diag.mod machine.mod cp_fm_basic_linalg.mod cp_fm_cholesky.mod cp_gemm_interface.mod qs_ot_eigensolver.mod cp_log_handling.mod qs_ks_methods.mod qs_gspace_mixing.mod qs_mixing_utils.mod qs_scf_block_davidson.mod qs_scf_methods.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_diagonalization.F qs_scf_diagonalization.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:16:56 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_diagonalization.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_diagonalization.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_scf_diagonalization.mod' due to: qs_scf_diagonalization.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_diagonalization.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_ks_types.mod cp_fm_types.mod cp_control_types.mod qs_energy_types.mod kpoint_types.mod cp_fm_pool_types.mod qs_rho_types.mod qs_rho_atom_types.mod cp_cfm_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod qs_density_mixing_types.mod qs_neighbor_list_types.mod preconditioner.mod cp_dbcsr_cp2k_link.mod cp_array_utils.mod cp_fm_struct.mod kpoint_methods.mod qs_diis.mod cp_fm_diag.mod qs_matrix_pools.mod qs_mo_methods.mod input_constants.mod qs_mo_occupation.mod kinds.mod qs_scf_lanczos.mod cp_output_handling.mod qs_rho_methods.mod cp_cfm_basic_linalg.mod base_hooks.mod cp_cfm_diag.mod machine.mod cp_fm_basic_linalg.mod cp_fm_cholesky.mod cp_gemm_interface.mod qs_ot_eigensolver.mod cp_log_handling.mod qs_ks_methods.mod qs_gspace_mixing.mod qs_mixing_utils.mod qs_scf_block_davidson.mod qs_scf_methods.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_mom_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_mom_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod cp_fm_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_fm_struct.mod string_utilities.mod qs_mo_methods.mod input_constants.mod kinds.mod cp_blacs_env.mod bibliography.mod base_hooks.mod util.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod qs_scf_diagonalization.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_mom_methods.F qs_mom_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:17:03 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_mom_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_mom_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_mom_methods.mod' due to: qs_mom_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_mom_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod cp_fm_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_fm_struct.mod string_utilities.mod qs_mo_methods.mod input_constants.mod kinds.mod cp_blacs_env.mod bibliography.mod base_hooks.mod util.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod qs_scf_diagonalization.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'kpoint_io.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_io.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_kind_types.mod atomic_kind_types.mod cp_fm_types.mod basis_set_types.mod kpoint_types.mod particle_types.mod qs_dftb_types.mod input_section_types.mod cp_para_types.mod qs_mo_io.mod kinds.mod qs_dftb_utils.mod cp_output_handling.mod base_hooks.mod cp_files.mod cp_log_handling.mod orbital_pointers.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_io.F kpoint_io.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:17:05 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kpoint_io.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kpoint_io.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'kpoint_io.mod' due to: kpoint_io.o /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_io.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_kind_types.mod atomic_kind_types.mod cp_fm_types.mod basis_set_types.mod kpoint_types.mod particle_types.mod qs_dftb_types.mod input_section_types.mod cp_para_types.mod qs_mo_io.mod kinds.mod qs_dftb_utils.mod cp_output_handling.mod base_hooks.mod cp_files.mod cp_log_handling.mod orbital_pointers.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_initial_guess.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_initial_guess.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod qs_scf_types.mod qs_kind_types.mod atomic_kind_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod xtb_types.mod kpoint_types.mod qs_rho_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod external_potential_types.mod cp_fm_struct.mod qs_wf_history_methods.mod qs_mom_methods.mod qs_mo_methods.mod input_constants.mod particle_methods.mod qs_mo_occupation.mod qs_mo_io.mod kinds.mod qs_dftb_utils.mod cp_output_handling.mod qs_rho_methods.mod atom_kind_orbitals.mod input_cp2k_hfx.mod base_hooks.mod util.mod kpoint_io.mod cp_fm_cholesky.mod cp_log_handling.mod qs_scf_methods.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_initial_guess.F qs_initial_guess.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:17:07 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_initial_guess.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_initial_guess.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_initial_guess.F:448:13: 448 | IF (not_read > 1) THEN | ^ Warning: ‘not_read’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_initial_guess.mod' due to: qs_initial_guess.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_initial_guess.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod qs_scf_types.mod qs_kind_types.mod atomic_kind_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod xtb_types.mod kpoint_types.mod qs_rho_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod external_potential_types.mod cp_fm_struct.mod qs_wf_history_methods.mod qs_mom_methods.mod qs_mo_methods.mod input_constants.mod particle_methods.mod qs_mo_occupation.mod qs_mo_io.mod kinds.mod qs_dftb_utils.mod cp_output_handling.mod qs_rho_methods.mod atom_kind_orbitals.mod input_cp2k_hfx.mod base_hooks.mod util.mod kpoint_io.mod cp_fm_cholesky.mod cp_log_handling.mod qs_scf_methods.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_fb_hash_table_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_hash_table_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod qs_hash_table_functions.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_hash_table_types.F qs_fb_hash_table_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:17:16 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_hash_table_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_hash_table_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_hash_table_types.F:339:34: 339 | SUBROUTINE fb_hash_table_remove(hash_table, key) | ^ Warning: ‘fb_hash_table_remove’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_hash_table_types.F:372:34: 372 | SUBROUTINE fb_hash_table_retain(hash_table) | ^ Warning: ‘fb_hash_table_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_hash_table_types.F:392:34: 392 | SUBROUTINE fb_hash_table_status(hash_table, nelements, nmax, prime) | ^ Warning: ‘fb_hash_table_status’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_fb_hash_table_types.mod' due to: qs_fb_hash_table_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_hash_table_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod qs_hash_table_functions.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_fb_buffer_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_buffer_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_buffer_types.F qs_fb_buffer_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:17:16 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_buffer_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_buffer_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_buffer_types.F:206:35: 206 | SUBROUTINE fb_buffer_i_associate(a, b) | ^ Warning: ‘fb_buffer_i_associate’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_buffer_types.F:524:35: 524 | SUBROUTINE fb_buffer_d_associate(a, b) | ^ Warning: ‘fb_buffer_d_associate’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_fb_buffer_types.mod' due to: qs_fb_buffer_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_buffer_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_fb_matrix_data_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_matrix_data_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_fb_hash_table_types.mod qs_fb_buffer_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_matrix_data_types.F qs_fb_matrix_data_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:17:17 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_matrix_data_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_matrix_data_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_matrix_data_types.F:141:38: 141 | SUBROUTINE fb_matrix_data_associate(a, b) | ^ Warning: ‘fb_matrix_data_associate’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_matrix_data_types.F:314:35: 314 | SUBROUTINE fb_matrix_data_retain(matrix_data) | ^ Warning: ‘fb_matrix_data_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_matrix_data_types.F:336:35: 336 | SUBROUTINE fb_matrix_data_status(matrix_data, nmax, nblks, nencode, blk_sizes) | ^ Warning: ‘fb_matrix_data_status’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_fb_matrix_data_types.mod' due to: qs_fb_matrix_data_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_matrix_data_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_fb_hash_table_types.mod qs_fb_buffer_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_fb_com_tasks_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_com_tasks_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_fb_matrix_data_types.mod base_hooks.mod kinds.mod util.mod memory_utilities.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_com_tasks_types.F qs_fb_com_tasks_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:17:18 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_com_tasks_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_com_tasks_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_com_tasks_types.F:159:33: 159 | SUBROUTINE fb_com_tasks_retain(com_tasks) | ^ Warning: ‘fb_com_tasks_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_com_tasks_types.F:173:38: 173 | SUBROUTINE fb_com_atom_pairs_retain(atom_pairs) | ^ Warning: ‘fb_com_atom_pairs_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_com_tasks_types.F:267:36: 267 | SUBROUTINE fb_com_tasks_associate(a, b) | ^ Warning: ‘fb_com_tasks_associate’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_com_tasks_types.F:280:41: 280 | SUBROUTINE fb_com_atom_pairs_associate(a, b) | ^ Warning: ‘fb_com_atom_pairs_associate’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_com_tasks_types.F:294:3: 294 | FUNCTION fb_com_tasks_has_data(com_tasks) RESULT(res) | ^ Warning: ‘fb_com_tasks_has_data’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_com_tasks_types.F:360:31: 360 | SUBROUTINE fb_com_tasks_init(com_tasks) | ^ Warning: ‘fb_com_tasks_init’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_fb_com_tasks_types.mod' due to: qs_fb_com_tasks_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_com_tasks_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_fb_matrix_data_types.mod base_hooks.mod kinds.mod util.mod memory_utilities.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_fb_atomic_matrix_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_atomic_matrix_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_fb_matrix_data_types.mod qs_fb_atomic_halo_types.mod qs_fb_com_tasks_types.mod base_hooks.mod kinds.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_atomic_matrix_methods.F qs_fb_atomic_matrix_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:17:20 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_atomic_matrix_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_atomic_matrix_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_fb_atomic_matrix_methods.mod' due to: qs_fb_atomic_matrix_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_atomic_matrix_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_fb_matrix_data_types.mod qs_fb_atomic_halo_types.mod qs_fb_com_tasks_types.mod base_hooks.mod kinds.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_fb_filter_matrix_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_filter_matrix_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_fb_com_tasks_types.mod qs_fb_matrix_data_types.mod particle_types.mod qs_fb_atomic_halo_types.mod atomic_kind_types.mod qs_fb_trial_fns_types.mod base_hooks.mod kinds.mod qs_fb_atomic_matrix_methods.mod string_utilities.mod message_passing.mod fermi_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_filter_matrix_methods.F qs_fb_filter_matrix_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:17:22 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_filter_matrix_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_filter_matrix_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_filter_matrix_methods.F:1434:39: 1434 | SUBROUTINE fb_fltrmat_fermi_dirac_ne(f, eigenvals, T, ne, maxocc) | ^ Warning: ‘fb_fltrmat_fermi_dirac_ne’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_fb_filter_matrix_methods.mod' due to: qs_fb_filter_matrix_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_filter_matrix_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_fb_com_tasks_types.mod qs_fb_matrix_data_types.mod particle_types.mod qs_fb_atomic_halo_types.mod atomic_kind_types.mod qs_fb_trial_fns_types.mod base_hooks.mod kinds.mod qs_fb_atomic_matrix_methods.mod string_utilities.mod message_passing.mod fermi_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_fb_env_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_env_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod qs_fb_atomic_halo_types.mod particle_types.mod qs_mo_types.mod qs_fb_env_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod qs_fb_trial_fns_types.mod cp_fm_struct.mod qs_diis.mod qs_matrix_pools.mod cp_fm_diag.mod string_utilities.mod qs_mo_methods.mod input_constants.mod qs_mo_occupation.mod kinds.mod cp_blacs_env.mod cp_output_handling.mod base_hooks.mod cp_fm_basic_linalg.mod cp_fm_cholesky.mod cp_units.mod cp_gemm_interface.mod qs_fb_filter_matrix_methods.mod cp_log_handling.mod qs_integral_utils.mod orbital_pointers.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_env_methods.F qs_fb_env_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:17:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_env_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_env_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_fb_env_methods.mod' due to: qs_fb_env_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_env_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod qs_fb_atomic_halo_types.mod particle_types.mod qs_mo_types.mod qs_fb_env_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod qs_fb_trial_fns_types.mod cp_fm_struct.mod qs_diis.mod qs_matrix_pools.mod cp_fm_diag.mod string_utilities.mod qs_mo_methods.mod input_constants.mod qs_mo_occupation.mod kinds.mod cp_blacs_env.mod cp_output_handling.mod base_hooks.mod cp_fm_basic_linalg.mod cp_fm_cholesky.mod cp_units.mod cp_gemm_interface.mod qs_fb_filter_matrix_methods.mod cp_log_handling.mod qs_integral_utils.mod orbital_pointers.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_fb_distribution_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_distribution_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod particle_types.mod qs_fb_atomic_halo_types.mod qs_kind_types.mod qs_fb_env_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod util.mod cp_output_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_distribution_methods.F qs_fb_distribution_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:17:30 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_distribution_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_distribution_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_distribution_methods.F:766:37: 766 | SUBROUTINE fb_distribution_move_el(dist_from, element, dist_to) | ^ Warning: ‘fb_distribution_move_el’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_fb_distribution_methods.mod' due to: qs_fb_distribution_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_fb_distribution_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod particle_types.mod qs_fb_atomic_halo_types.mod qs_kind_types.mod qs_fb_env_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod util.mod cp_output_handling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ai_kinetic.mod' due to: ai_kinetic.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_kinetic.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_kinetic.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod basis_set_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod kpoint_types.mod qs_neighbor_list_types.mod kinds.mod base_hooks.mod ai_contraction.mod qs_overlap.mod ai_kinetic.mod qs_integral_utils.mod orbital_pointers.mod virial_methods.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_kinetic.F qs_kinetic.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:17:33 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_kinetic.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_kinetic.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_kinetic.F:165:95: 165 | trans, use_cell_mapping, use_virial | ^ Warning: ‘use_virial’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_kinetic.F:264:46: 264 | !$OMP REDUCTION (+ : pv_thread, force_thread ) | ^ Warning: ‘use_cell_mapping’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_kinetic.F:164:89: 164 | LOGICAL :: do_forces, do_symmetric, dokp, found, & | ^ Warning: ‘dokp’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_kinetic.mod' due to: qs_kinetic.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_kinetic.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod basis_set_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod kpoint_types.mod qs_neighbor_list_types.mod kinds.mod base_hooks.mod ai_contraction.mod qs_overlap.mod ai_kinetic.mod qs_integral_utils.mod orbital_pointers.mod virial_methods.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ai_verfc.mod' due to: ai_verfc.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'core_ae.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/core_ae.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_force_types.mod qs_neighbor_list_types.mod external_potential_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod virial_types.mod base_hooks.mod kinds.mod ai_verfc.mod orbital_pointers.mod virial_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/core_ae.F core_ae.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:17:36 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"core_ae.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' core_ae.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'core_ae.mod' due to: core_ae.o /build/cp2k-Q381vr/cp2k-8.1/src/core_ae.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_force_types.mod qs_neighbor_list_types.mod external_potential_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod virial_types.mod base_hooks.mod kinds.mod ai_verfc.mod orbital_pointers.mod virial_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'kg_tnadd_mat.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/kg_tnadd_mat.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_force_types.mod qs_neighbor_list_types.mod external_potential_types.mod kg_environment_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod virial_types.mod base_hooks.mod kinds.mod cp_dbcsr_cp2k_link.mod orbital_pointers.mod virial_methods.mod cp_dbcsr_operations.mod ai_overlap_ppl.mod particle_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/kg_tnadd_mat.F kg_tnadd_mat.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:17:43 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kg_tnadd_mat.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kg_tnadd_mat.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'kg_tnadd_mat.mod' due to: kg_tnadd_mat.o /build/cp2k-Q381vr/cp2k-8.1/src/kg_tnadd_mat.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_force_types.mod qs_neighbor_list_types.mod external_potential_types.mod kg_environment_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod virial_types.mod base_hooks.mod kinds.mod cp_dbcsr_cp2k_link.mod orbital_pointers.mod virial_methods.mod cp_dbcsr_operations.mod ai_overlap_ppl.mod particle_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'core_ppnl.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/core_ppnl.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod sap_kind_types.mod qs_force_types.mod qs_neighbor_list_types.mod external_potential_types.mod particle_types.mod qs_kind_types.mod virial_types.mod atomic_kind_types.mod base_hooks.mod kinds.mod orbital_pointers.mod virial_methods.mod ai_overlap.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/core_ppnl.F core_ppnl.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:17:47 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"core_ppnl.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' core_ppnl.F90 /build/cp2k-Q381vr/cp2k-8.1/src/core_ppnl.F:106:89: 106 | ldsab, lppnl, maxco, maxder, maxl, maxlgto, maxlppnl, maxppnl, maxsgf, na, natom, nb, & | ^ Warning: ‘natom’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/core_ppnl.F:131:76: 131 | REAL(KIND=dp), DIMENSION(:), POINTER :: a_nl, alpha_ppnl, hprj, set_radius_a | ^ Warning: ‘alpha_ppnl.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/core_ppnl.F:131:76: Warning: ‘alpha_ppnl.span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/core_ppnl.F:131:76: Warning: ‘alpha_ppnl.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/core_ppnl.F:131:76: Warning: ‘alpha_ppnl.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/core_ppnl.F:110:92: 110 | INTEGER, DIMENSION(:), POINTER :: la_max, la_min, npgfa, nprj_ppnl, & | ^ Warning: ‘nprj_ppnl.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/core_ppnl.F:110:92: Warning: ‘nprj_ppnl.span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/core_ppnl.F:110:92: Warning: ‘nprj_ppnl.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/core_ppnl.F:110:92: Warning: ‘nprj_ppnl.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/core_ppnl.F:130:77: 130 | sphi_a, vprj_ppnl, zeta | ^ Warning: ‘vprj_ppnl.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/core_ppnl.F:130:77: Warning: ‘vprj_ppnl.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/core_ppnl.F:130:77: Warning: ‘vprj_ppnl.span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/core_ppnl.F:130:77: Warning: ‘vprj_ppnl.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/core_ppnl.F:130:77: Warning: ‘vprj_ppnl.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/core_ppnl.F:131:82: 131 | REAL(KIND=dp), DIMENSION(:), POINTER :: a_nl, alpha_ppnl, hprj, set_radius_a | ^ Warning: ‘hprj.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/core_ppnl.F:131:82: Warning: ‘hprj.span’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/core_ppnl.F:131:82: Warning: ‘hprj.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/core_ppnl.F:131:82: Warning: ‘hprj.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/core_ppnl.F:401:111: 401 | work(1:np, 1:nb) = MATMUL(sab(1:np, first_col:first_col + nprjc - 1), cprj(1:nprjc, 1:nb)) | ^ Warning: ‘nprjc’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/core_ppnl.F:107:67: 107 | ncoa, ncoc, nkind, nlist, nneighbor, nnl, np, nppnl, nprjc, nseta, nsgfa, prjc, sgfa, slot | ^ note: ‘nprjc’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'core_ppnl.mod' due to: core_ppnl.o /build/cp2k-Q381vr/cp2k-8.1/src/core_ppnl.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod sap_kind_types.mod qs_force_types.mod qs_neighbor_list_types.mod external_potential_types.mod particle_types.mod qs_kind_types.mod virial_types.mod atomic_kind_types.mod base_hooks.mod kinds.mod orbital_pointers.mod virial_methods.mod ai_overlap.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_core_hamiltonian.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_core_hamiltonian.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod lri_environment_types.mod atomic_kind_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod kpoint_types.mod qs_rho_types.mod kg_environment_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_oce_types.mod qs_kinetic.mod cp_dbcsr_cp2k_link.mod cp_dbcsr_output.mod input_constants.mod core_ae.mod kinds.mod cp_blacs_env.mod cp_output_handling.mod base_hooks.mod qs_overlap.mod kg_tnadd_mat.mod core_ppl.mod qs_oce_methods.mod core_ppnl.mod cp_log_handling.mod qs_condnum.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_core_hamiltonian.F qs_core_hamiltonian.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:17:56 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_core_hamiltonian.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_core_hamiltonian.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_core_hamiltonian.mod' due to: qs_core_hamiltonian.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_core_hamiltonian.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod lri_environment_types.mod atomic_kind_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod kpoint_types.mod qs_rho_types.mod kg_environment_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_oce_types.mod qs_kinetic.mod cp_dbcsr_cp2k_link.mod cp_dbcsr_output.mod input_constants.mod core_ae.mod kinds.mod cp_blacs_env.mod cp_output_handling.mod base_hooks.mod qs_overlap.mod kg_tnadd_mat.mod core_ppl.mod qs_oce_methods.mod core_ppnl.mod cp_log_handling.mod qs_condnum.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_update_s_mstruct.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_update_s_mstruct.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_ddapc_types.mod qs_environment_types.mod qs_rho_types.mod task_list_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_scf_types.mod qs_ks_types.mod pw_types.mod base_hooks.mod cp_ddapc_util.mod pw_methods.mod qs_rho_methods.mod input_constants.mod qs_collocate_density.mod task_list_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_update_s_mstruct.F qs_update_s_mstruct.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:18:02 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_update_s_mstruct.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_update_s_mstruct.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_update_s_mstruct.mod' due to: qs_update_s_mstruct.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_update_s_mstruct.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_ddapc_types.mod qs_environment_types.mod qs_rho_types.mod task_list_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_scf_types.mod qs_ks_types.mod pw_types.mod base_hooks.mod cp_ddapc_util.mod pw_methods.mod qs_rho_methods.mod input_constants.mod qs_collocate_density.mod task_list_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_basis_gradient.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_basis_gradient.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cp_fm_types.mod qs_force_types.mod cp_control_types.mod qs_rho_types.mod qs_subsys_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_mo_methods.mod kinds.mod qs_energy_matrix_w.mod qs_rho_methods.mod base_hooks.mod qs_core_hamiltonian.mod cp_log_handling.mod qs_ks_methods.mod qs_mixing_utils.mod qs_update_s_mstruct.mod cp_dbcsr_operations.mod qs_neighbor_lists.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_basis_gradient.F qs_basis_gradient.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:18:05 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_basis_gradient.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_basis_gradient.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_basis_gradient.mod' due to: qs_basis_gradient.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_basis_gradient.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cp_fm_types.mod qs_force_types.mod cp_control_types.mod qs_rho_types.mod qs_subsys_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_mo_methods.mod kinds.mod qs_energy_matrix_w.mod qs_rho_methods.mod base_hooks.mod qs_core_hamiltonian.mod cp_log_handling.mod qs_ks_methods.mod qs_mixing_utils.mod qs_update_s_mstruct.mod cp_dbcsr_operations.mod qs_neighbor_lists.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_outer_scf.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_outer_scf.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod qs_cdft_types.mod qs_environment_types.mod cp_control_types.mod qs_scf_types.mod qs_cdft_opt_types.mod scf_control_types.mod base_hooks.mod cp_log_handling.mod mathlib.mod kinds.mod qs_basis_gradient.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_outer_scf.F qs_outer_scf.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:18:10 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_outer_scf.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_outer_scf.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_outer_scf.F:511:60: 511 | ddapc_restraint_control%strength = extrapolation(1) | ^ Warning: ‘ddapc_restraint_control’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_outer_scf.F:415:88: 415 | ddapc_restraint_control%strength = scf_env%outer_scf%variables(1, ihistory + 1) | ^ Warning: ‘ddapc_restraint_control’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_outer_scf.F:141:17: 141 | CPASSERT(is_constraint) | ^ Warning: ‘is_constraint’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_outer_scf.F:145:81: 145 | ddapc_restraint_control%target | ^ Warning: ‘ddapc_restraint_control’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_outer_scf.mod' due to: qs_outer_scf.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_outer_scf.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod qs_cdft_types.mod qs_environment_types.mod cp_control_types.mod qs_scf_types.mod qs_cdft_opt_types.mod scf_control_types.mod base_hooks.mod cp_log_handling.mod mathlib.mod kinds.mod qs_basis_gradient.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_scf_initialization.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_initialization.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_kind_types.mod qs_ks_types.mod pw_types.mod cp_fm_types.mod qs_cdft_opt_types.mod xas_env_types.mod cp_control_types.mod kpoint_types.mod cp_fm_pool_types.mod qs_rho_types.mod qs_block_davidson_types.mod qs_rho_atom_types.mod qs_mo_types.mod qs_fb_env_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod qs_density_mixing_types.mod cp_fm_struct.mod qs_matrix_pools.mod qs_wf_history_methods.mod qs_scf_output.mod cp_fm_diag.mod cp_dbcsr_output.mod xas_restart.mod input_constants.mod qs_mo_occupation.mod kinds.mod qmmm_image_charge.mod qs_scf_lanczos.mod cp_output_handling.mod qs_rho_methods.mod qs_initial_guess.mod base_hooks.mod qs_fb_env_methods.mod cp_fm_basic_linalg.mod cp_fm_cholesky.mod cp_log_handling.mod qs_mixing_utils.mod qs_scf_diagonalization.mod qs_fb_distribution_methods.mod cp_dbcsr_operations.mod qs_outer_scf.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_initialization.F qs_scf_initialization.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:18:17 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_initialization.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_initialization.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_scf_initialization.mod' due to: qs_scf_initialization.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_initialization.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_kind_types.mod qs_ks_types.mod pw_types.mod cp_fm_types.mod qs_cdft_opt_types.mod xas_env_types.mod cp_control_types.mod kpoint_types.mod cp_fm_pool_types.mod qs_rho_types.mod qs_block_davidson_types.mod qs_rho_atom_types.mod qs_mo_types.mod qs_fb_env_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod qs_density_mixing_types.mod cp_fm_struct.mod qs_matrix_pools.mod qs_wf_history_methods.mod qs_scf_output.mod cp_fm_diag.mod cp_dbcsr_output.mod xas_restart.mod input_constants.mod qs_mo_occupation.mod kinds.mod qmmm_image_charge.mod qs_scf_lanczos.mod cp_output_handling.mod qs_rho_methods.mod qs_initial_guess.mod base_hooks.mod qs_fb_env_methods.mod cp_fm_basic_linalg.mod cp_fm_cholesky.mod cp_log_handling.mod qs_mixing_utils.mod qs_scf_diagonalization.mod qs_fb_distribution_methods.mod cp_dbcsr_operations.mod qs_outer_scf.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'se_core_matrix.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/se_core_matrix.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod qs_rho_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_dbcsr_output.mod input_constants.mod kinds.mod semi_empirical_utils.mod cp_output_handling.mod semi_empirical_int_arrays.mod base_hooks.mod physcon.mod qs_overlap.mod cp_log_handling.mod virial_methods.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/se_core_matrix.F se_core_matrix.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:18:24 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"se_core_matrix.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' se_core_matrix.F90 /build/cp2k-Q381vr/cp2k-8.1/src/se_core_matrix.F:427:19: 427 | SUBROUTINE makeS(R, nra, nrb, ZSA, ZSB, ZPA, ZPB, S) | ^ Warning: ‘makes’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/se_core_matrix.F:803:20: 803 | SUBROUTINE makedS(R, nra, nrb, ZSA, ZSB, ZPA, ZPB, dS) | ^ Warning: ‘makeds’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/se_core_matrix.F:373:66: 373 | force(jkind)%all_potential(:, atom_b) + force_ab(:) | ^ Warning: ‘atom_b’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/se_core_matrix.F:371:66: 371 | force(ikind)%all_potential(:, atom_a) - force_ab(:) | ^ Warning: ‘atom_a’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'se_core_matrix.mod' due to: se_core_matrix.o /build/cp2k-Q381vr/cp2k-8.1/src/se_core_matrix.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod qs_rho_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_dbcsr_output.mod input_constants.mod kinds.mod semi_empirical_utils.mod cp_output_handling.mod semi_empirical_int_arrays.mod base_hooks.mod physcon.mod qs_overlap.mod cp_log_handling.mod virial_methods.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'optimize_embedding_potential.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/optimize_embedding_potential.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod qs_kind_types.mod qs_ks_types.mod lri_environment_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod force_env_types.mod cp_control_types.mod qs_rho_types.mod qs_subsys_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod embed_types.mod pw_env_types.mod pw_poisson_types.mod xc_rho_set_types.mod particle_list_types.mod qs_kinetic.mod cp_fm_struct.mod cp_fm_diag.mod pw_methods.mod input_constants.mod pw_poisson_methods.mod qs_integrate_potential_single.mod cp_realspace_grid_cube.mod kinds.mod cp_blacs_env.mod cp_output_handling.mod qs_collocate_density.mod base_hooks.mod mixed_environment_utils.mod mathconstants.mod xc.mod cp_fm_basic_linalg.mod cp_files.mod cp_gemm_interface.mod cp_log_handling.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/optimize_embedding_potential.F optimize_embedding_potential.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:18:29 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"optimize_embedding_potential.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' optimize_embedding_potential.F90 /build/cp2k-Q381vr/cp2k-8.1/src/optimize_embedding_potential.F:1977:32: 1977 | SUBROUTINE inv_Hessian_update(grad, prev_grad, step, prev_inv_Hess, inv_Hess) | ^ Warning: ‘inv_hessian_update’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/optimize_embedding_potential.F:2085:28: 2085 | SUBROUTINE Hessian_update(grad, prev_grad, step, prev_Hess, Hess) | ^ Warning: ‘hessian_update’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/optimize_embedding_potential.F:3430:40: 3430 | CALL pw_release(pot_beta%pw) | ^ Warning: ‘pot_beta’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'optimize_embedding_potential.mod' due to: optimize_embedding_potential.o /build/cp2k-Q381vr/cp2k-8.1/src/optimize_embedding_potential.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod qs_kind_types.mod qs_ks_types.mod lri_environment_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod force_env_types.mod cp_control_types.mod qs_rho_types.mod qs_subsys_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod embed_types.mod pw_env_types.mod pw_poisson_types.mod xc_rho_set_types.mod particle_list_types.mod qs_kinetic.mod cp_fm_struct.mod cp_fm_diag.mod pw_methods.mod input_constants.mod pw_poisson_methods.mod qs_integrate_potential_single.mod cp_realspace_grid_cube.mod kinds.mod cp_blacs_env.mod cp_output_handling.mod qs_collocate_density.mod base_hooks.mod mixed_environment_utils.mod mathconstants.mod xc.mod cp_fm_basic_linalg.mod cp_files.mod cp_gemm_interface.mod cp_log_handling.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_dftb_dispersion.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_dispersion.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod atprop_types.mod particle_types.mod qs_dftb_types.mod qs_dispersion_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_dispersion_pairpot.mod input_constants.mod kinds.mod qs_dftb_utils.mod base_hooks.mod message_passing.mod virial_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_dispersion.F qs_dftb_dispersion.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:18:40 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dftb_dispersion.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dftb_dispersion.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_dftb_dispersion.mod' due to: qs_dftb_dispersion.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_dispersion.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod atprop_types.mod particle_types.mod qs_dftb_types.mod qs_dispersion_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_dispersion_pairpot.mod input_constants.mod kinds.mod qs_dftb_utils.mod base_hooks.mod message_passing.mod virial_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_gcp_method.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_gcp_method.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod atprop_types.mod qs_force_types.mod qs_neighbor_list_types.mod particle_types.mod qs_gcp_types.mod qs_kind_types.mod virial_types.mod atomic_kind_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod message_passing.mod virial_methods.mod ai_overlap.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_gcp_method.F qs_gcp_method.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:18:43 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_gcp_method.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_gcp_method.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_gcp_method.F:286:13: 286 | IF (use_virial) THEN | ^ Warning: ‘use_virial’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_gcp_method.F:236:80: 236 | CALL virial_pair_force(atstr(:, :, iatom), -0.5_dp, fdij, rij) | ^ Warning: ‘atstr.dim[2].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_gcp_method.F:236:80: Warning: ‘atstr.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_gcp_method.F:237:80: 237 | CALL virial_pair_force(atstr(:, :, jatom), -0.5_dp, fdij, rij) | ^ Warning: ‘atstr.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_gcp_method.F:86:65: 86 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: atstr | ^ Warning: ‘atstr.dim[1].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_gcp_method.F:86:65: Warning: ‘atstr.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_gcp_method.F:86:65: Warning: ‘atstr.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_gcp_method.F:86:65: Warning: ‘atstr.dim[0].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_gcp_method.F:86:65: Warning: ‘atstr.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_gcp_method.F:236:80: 236 | CALL virial_pair_force(atstr(:, :, iatom), -0.5_dp, fdij, rij) | ^ Warning: ‘atstr.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_gcp_method.mod' due to: qs_gcp_method.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_gcp_method.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod atprop_types.mod qs_force_types.mod qs_neighbor_list_types.mod particle_types.mod qs_gcp_types.mod qs_kind_types.mod virial_types.mod atomic_kind_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod message_passing.mod virial_methods.mod ai_overlap.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_min_heap.mod' due to: cp_min_heap.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'kg_vertex_coloring_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/kg_vertex_coloring_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 kg_environment_types.mod base_hooks.mod cp_log_handling.mod cp_min_heap.mod kinds.mod bibliography.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/kg_vertex_coloring_methods.F kg_vertex_coloring_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:18:46 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kg_vertex_coloring_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kg_vertex_coloring_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/kg_vertex_coloring_methods.F:201:54: 201 | IF (newcolor .GT. ncolors) ncolors = newcolor | ^ Warning: ‘newcolor’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/kg_vertex_coloring_methods.F:174:89: 174 | INTEGER :: color, handle, i, j, newcolor, & | ^ note: ‘newcolor’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/kg_vertex_coloring_methods.F:120:36: 120 | nneighbors = nneighbors + 1 | ^ Warning: ‘nneighbors’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/kg_vertex_coloring_methods.F:77:81: 77 | maxdegree, nneighbors, nnodes | ^ note: ‘nneighbors’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'kg_vertex_coloring_methods.mod' due to: kg_vertex_coloring_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/kg_vertex_coloring_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 kg_environment_types.mod base_hooks.mod cp_log_handling.mod cp_min_heap.mod kinds.mod bibliography.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'generic_shg_integrals_init.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/shg_int/generic_shg_integrals_init.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod base_hooks.mod kinds.mod mathconstants.mod memory_utilities.mod orbital_pointers.mod spherical_harmonics.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/shg_int/generic_shg_integrals_init.F generic_shg_integrals_init.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:18:48 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"shg_int/generic_shg_integrals_init.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/shg_int/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' generic_shg_integrals_init.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'generic_shg_integrals_init.mod' due to: generic_shg_integrals_init.o /build/cp2k-Q381vr/cp2k-8.1/src/shg_int/generic_shg_integrals_init.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod base_hooks.mod kinds.mod mathconstants.mod memory_utilities.mod orbital_pointers.mod spherical_harmonics.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'lri_environment_init.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/lri_environment_init.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_environment_types.mod cp_control_types.mod qs_kind_types.mod lri_environment_types.mod atomic_kind_types.mod input_section_types.mod base_hooks.mod kinds.mod mathlib.mod mathconstants.mod bibliography.mod generic_shg_integrals.mod ao_util.mod generic_shg_integrals_init.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/lri_environment_init.F lri_environment_init.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:18:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_environment_init.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_environment_init.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'lri_environment_init.mod' due to: lri_environment_init.o /build/cp2k-Q381vr/cp2k-8.1/src/lri_environment_init.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_environment_types.mod cp_control_types.mod qs_kind_types.mod lri_environment_types.mod atomic_kind_types.mod input_section_types.mod base_hooks.mod kinds.mod mathlib.mod mathconstants.mod bibliography.mod generic_shg_integrals.mod ao_util.mod generic_shg_integrals_init.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'kg_environment.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/kg_environment.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod integration_grid_types.mod distribution_2d_types.mod task_list_types.mod kg_environment_types.mod particle_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod distribution_1d_types.mod external_potential_types.mod string_utilities.mod input_constants.mod kinds.mod bibliography.mod base_hooks.mod kg_vertex_coloring_methods.mod util.mod cp_files.mod qs_grid_atom.mod cp_log_handling.mod lri_environment_init.mod message_passing.mod qs_neighbor_lists.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/kg_environment.F kg_environment.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:18:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kg_environment.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kg_environment.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'kg_environment.mod' due to: kg_environment.o /build/cp2k-Q381vr/cp2k-8.1/src/kg_environment.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod integration_grid_types.mod distribution_2d_types.mod task_list_types.mod kg_environment_types.mod particle_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod distribution_1d_types.mod external_potential_types.mod string_utilities.mod input_constants.mod kinds.mod bibliography.mod base_hooks.mod kg_vertex_coloring_methods.mod util.mod cp_files.mod qs_grid_atom.mod cp_log_handling.mod lri_environment_init.mod message_passing.mod qs_neighbor_lists.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'maxwell_solver_interface.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/maxwell_solver_interface.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod pw_types.mod base_hooks.mod cp_log_handling.mod kinds.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/maxwell_solver_interface.F maxwell_solver_interface.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:18:58 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"maxwell_solver_interface.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' maxwell_solver_interface.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'maxwell_solver_interface.mod' due to: maxwell_solver_interface.o /build/cp2k-Q381vr/cp2k-8.1/src/maxwell_solver_interface.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod pw_types.mod base_hooks.mod cp_log_handling.mod kinds.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_external_potential.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_external_potential.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod qs_force_types.mod cp_control_types.mod qs_energy_types.mod particle_types.mod input_section_types.mod qs_environment_types.mod string_utilities.mod maxwell_solver_interface.mod cp_realspace_grid_cube.mod kinds.mod fparser.mod force_fields_util.mod base_hooks.mod cp_log_handling.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_external_potential.F qs_external_potential.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:18:59 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_external_potential.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_external_potential.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_external_potential.mod' due to: qs_external_potential.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_external_potential.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod qs_force_types.mod cp_control_types.mod qs_energy_types.mod particle_types.mod input_section_types.mod qs_environment_types.mod string_utilities.mod maxwell_solver_interface.mod cp_realspace_grid_cube.mod kinds.mod fparser.mod force_fields_util.mod base_hooks.mod cp_log_handling.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'se_core_core.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/se_core_core.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod atprop_types.mod particle_types.mod ewald_environment_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod ewald_pw_types.mod input_constants.mod kinds.mod semi_empirical_utils.mod semi_empirical_int_arrays.mod base_hooks.mod message_passing.mod virial_methods.mod semi_empirical_integrals.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/se_core_core.F se_core_core.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:19:03 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"se_core_core.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' se_core_core.F90 /build/cp2k-Q381vr/cp2k-8.1/src/se_core_core.F:213:53: 213 | dr3inv = -3.0_dp*rij*r3inv*r2inv | ^ Warning: ‘r3inv’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/se_core_core.F:213:53: Warning: ‘r2inv’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'se_core_core.mod' due to: se_core_core.o /build/cp2k-Q381vr/cp2k-8.1/src/se_core_core.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod atprop_types.mod particle_types.mod ewald_environment_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod ewald_pw_types.mod input_constants.mod kinds.mod semi_empirical_utils.mod semi_empirical_int_arrays.mod base_hooks.mod message_passing.mod virial_methods.mod semi_empirical_integrals.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_external_density.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_external_density.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_environment_types.mod qs_rho_types.mod cp_control_types.mod pw_env_types.mod input_section_types.mod realspace_grid_types.mod cell_types.mod base_hooks.mod rs_pw_interface.mod kinds.mod gaussian_gridlevels.mod pw_methods.mod message_passing.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_external_density.F qs_external_density.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:19:05 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_external_density.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_external_density.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_external_density.mod' due to: qs_external_density.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_external_density.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_environment_types.mod qs_rho_types.mod cp_control_types.mod pw_env_types.mod input_section_types.mod realspace_grid_types.mod cell_types.mod base_hooks.mod rs_pw_interface.mod kinds.mod gaussian_gridlevels.mod pw_methods.mod message_passing.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_energy_init.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy_init.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod lri_environment_types.mod cp_control_types.mod qs_energy_types.mod kpoint_types.mod kg_environment_types.mod qs_gcp_types.mod molecule_types.mod qs_dispersion_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod se_core_matrix.mod optimize_embedding_potential.mod qs_dispersion_pairpot.mod kpoint_methods.mod ri_environment_methods.mod input_constants.mod lri_environment_methods.mod xtb_matrices.mod kinds.mod qs_dftb_dispersion.mod qs_gcp_method.mod efield_utils.mod base_hooks.mod kg_environment.mod qs_external_potential.mod qs_dftb_matrices.mod qs_core_energies.mod qs_core_hamiltonian.mod qs_ks_methods.mod se_core_core.mod qs_external_density.mod qs_update_s_mstruct.mod cp_dbcsr_operations.mod qs_neighbor_lists.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy_init.F qs_energy_init.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:19:07 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_energy_init.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_energy_init.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_energy_init.mod' due to: qs_energy_init.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy_init.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod lri_environment_types.mod cp_control_types.mod qs_energy_types.mod kpoint_types.mod kg_environment_types.mod qs_gcp_types.mod molecule_types.mod qs_dispersion_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod se_core_matrix.mod optimize_embedding_potential.mod qs_dispersion_pairpot.mod kpoint_methods.mod ri_environment_methods.mod input_constants.mod lri_environment_methods.mod xtb_matrices.mod kinds.mod qs_dftb_dispersion.mod qs_gcp_method.mod efield_utils.mod base_hooks.mod kg_environment.mod qs_external_potential.mod qs_dftb_matrices.mod qs_core_energies.mod qs_core_hamiltonian.mod qs_ks_methods.mod se_core_core.mod qs_external_density.mod qs_update_s_mstruct.mod cp_dbcsr_operations.mod qs_neighbor_lists.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'header.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/header.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod cp2k_info.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/header.F header.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:19:14 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"header.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' header.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'header.mod' due to: header.o /build/cp2k-Q381vr/cp2k-8.1/src/header.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod cp2k_info.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'semi_empirical_expns3_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_expns3_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod cp_control_types.mod qs_kind_types.mod semi_empirical_expns3_types.mod base_hooks.mod kinds.mod semi_empirical_utils.mod input_constants.mod semi_empirical_int3_utils.mod semi_empirical_int_arrays.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_expns3_methods.F semi_empirical_expns3_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:19:14 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_expns3_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_expns3_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'semi_empirical_expns3_methods.mod' due to: semi_empirical_expns3_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_expns3_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod cp_control_types.mod qs_kind_types.mod semi_empirical_expns3_types.mod base_hooks.mod kinds.mod semi_empirical_utils.mod input_constants.mod semi_empirical_int3_utils.mod semi_empirical_int_arrays.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'almo_scf_env_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_env_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 almo_scf_types.mod qs_environment_types.mod cp_control_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_env_methods.F almo_scf_env_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:19:15 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"almo_scf_env_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' almo_scf_env_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'almo_scf_env_methods.mod' due to: almo_scf_env_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_env_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 almo_scf_types.mod qs_environment_types.mod cp_control_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'molsym.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/molsym.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod mathlib.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/molsym.F molsym.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:19:19 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"molsym.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molsym.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'molsym.mod' due to: molsym.o /build/cp2k-Q381vr/cp2k-8.1/src/molsym.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod mathlib.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_symmetry.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/cp_symmetry.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod atomic_kind_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod molsym.mod cp_output_handling.mod string_utilities.mod cryssym.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/cp_symmetry.F cp_symmetry.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:19:25 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_symmetry.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_symmetry.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_symmetry.mod' due to: cp_symmetry.o /build/cp2k-Q381vr/cp2k-8.1/src/cp_symmetry.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod atomic_kind_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod molsym.mod cp_output_handling.mod string_utilities.mod cryssym.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_dispersion_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_kind_types.mod atomic_kind_types.mod qs_dispersion_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod qs_dispersion_pairpot.mod physcon.mod cp_output_handling.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_utils.F qs_dispersion_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:19:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dispersion_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dispersion_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_dispersion_utils.mod' due to: qs_dispersion_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_dispersion_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_kind_types.mod atomic_kind_types.mod qs_dispersion_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod qs_dispersion_pairpot.mod physcon.mod cp_output_handling.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ec_environment.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/ec_environment.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod basis_set_types.mod basis_set_container_types.mod cp_control_types.mod ec_env_types.mod qs_dispersion_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_dispersion_pairpot.mod string_utilities.mod input_constants.mod kinds.mod qs_dispersion_utils.mod input_cp2k_check.mod base_hooks.mod qs_interactions.mod orbital_pointers.mod qs_dispersion_nonloc.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/ec_environment.F ec_environment.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:19:28 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ec_environment.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ec_environment.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ec_environment.mod' due to: ec_environment.o /build/cp2k-Q381vr/cp2k-8.1/src/ec_environment.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod basis_set_types.mod basis_set_container_types.mod cp_control_types.mod ec_env_types.mod qs_dispersion_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_dispersion_pairpot.mod string_utilities.mod input_constants.mod kinds.mod qs_dispersion_utils.mod input_cp2k_check.mod base_hooks.mod qs_interactions.mod orbital_pointers.mod qs_dispersion_nonloc.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ewald_pw_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/ewald_pw_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dg_types.mod pw_grid_types.mod dg_rho0_types.mod pw_pool_types.mod pw_poisson_types.mod ewald_pw_types.mod input_section_types.mod ewald_environment_types.mod base_hooks.mod kinds.mod dgs.mod pw_poisson_read_input.mod pw_poisson_methods.mod pw_grids.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/ewald_pw_methods.F ewald_pw_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:19:31 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ewald_pw_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ewald_pw_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ewald_pw_methods.mod' due to: ewald_pw_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/ewald_pw_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dg_types.mod pw_grid_types.mod dg_rho0_types.mod pw_pool_types.mod pw_poisson_types.mod ewald_pw_types.mod input_section_types.mod ewald_environment_types.mod base_hooks.mod kinds.mod dgs.mod pw_poisson_read_input.mod pw_poisson_methods.mod pw_grids.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pao_optimizer.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pao_optimizer.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pao_types.mod base_hooks.mod kinds.mod arnoldi_api.mod pao_input.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pao_optimizer.F pao_optimizer.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:19:32 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_optimizer.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_optimizer.F90 /build/cp2k-Q381vr/cp2k-8.1/src/pao_optimizer.F:197:13: 197 | IF (beta < 0.0_dp) THEN | ^ Warning: ‘beta’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pao_optimizer.mod' due to: pao_optimizer.o /build/cp2k-Q381vr/cp2k-8.1/src/pao_optimizer.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pao_types.mod base_hooks.mod kinds.mod arnoldi_api.mod pao_input.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pao_linpot_full.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pao_linpot_full.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_environment_types.mod qs_kind_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pao_linpot_full.F pao_linpot_full.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:19:33 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_linpot_full.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_linpot_full.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pao_linpot_full.mod' due to: pao_linpot_full.o /build/cp2k-Q381vr/cp2k-8.1/src/pao_linpot_full.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_environment_types.mod qs_kind_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pao_linpot_rotinv.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pao_linpot_rotinv.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_environment_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod base_hooks.mod kinds.mod mathlib.mod mathconstants.mod orbital_pointers.mod ai_overlap.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pao_linpot_rotinv.F pao_linpot_rotinv.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:19:34 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_linpot_rotinv.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_linpot_rotinv.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pao_linpot_rotinv.mod' due to: pao_linpot_rotinv.o /build/cp2k-Q381vr/cp2k-8.1/src/pao_linpot_rotinv.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_environment_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod base_hooks.mod kinds.mod mathlib.mod mathconstants.mod orbital_pointers.mod ai_overlap.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pao_param_fock.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pao_param_fock.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pao_types.mod base_hooks.mod kinds.mod mathlib.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pao_param_fock.F pao_param_fock.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:19:43 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_param_fock.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_param_fock.F90 /build/cp2k-Q381vr/cp2k-8.1/src/pao_param_fock.F:155:83: 155 | D2(i, i) = D2(i, i) - 2.0_dp*alpha*diff/beta**2*EXP(-(diff/beta)**2) | ^ Warning: ‘beta’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pao_param_fock.F:155:83: Warning: ‘alpha’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pao_param_fock.mod' due to: pao_param_fock.o /build/cp2k-Q381vr/cp2k-8.1/src/pao_param_fock.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pao_types.mod base_hooks.mod kinds.mod mathlib.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pao_potentials.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pao_potentials.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_environment_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod base_hooks.mod kinds.mod mathlib.mod mathconstants.mod orbital_pointers.mod ai_overlap.mod ao_util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pao_potentials.F pao_potentials.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:19:47 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_potentials.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_potentials.F90 /build/cp2k-Q381vr/cp2k-8.1/src/pao_potentials.F:119:76: 119 | REAL(dp), DIMENSION(:, :, :), POINTER :: dab, new_block_D, saab | ^ Warning: ‘new_block_d.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pao_potentials.F:231:83: 231 | iset=iset, ishell=ishell, jset=jset, jshell=jshell) | ^ Warning: ‘new_block_d.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pao_potentials.F:231:83: Warning: ‘new_block_d.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pao_potentials.F:231:83: Warning: ‘new_block_d.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pao_potentials.F:119:76: 119 | REAL(dp), DIMENSION(:, :, :), POINTER :: dab, new_block_D, saab | ^ Warning: ‘new_block_d.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pao_potentials.mod' due to: pao_potentials.o /build/cp2k-Q381vr/cp2k-8.1/src/pao_potentials.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_environment_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod base_hooks.mod kinds.mod mathlib.mod mathconstants.mod orbital_pointers.mod ai_overlap.mod ao_util.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pao_param_linpot.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pao_param_linpot.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pao_types.mod qs_kind_types.mod atomic_kind_types.mod basis_set_types.mod cp_control_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod mathlib.mod pao_linpot_full.mod pao_linpot_rotinv.mod pao_input.mod kinds.mod base_hooks.mod machine.mod pao_param_fock.mod message_passing.mod pao_potentials.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pao_param_linpot.F pao_param_linpot.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:19:52 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_param_linpot.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_param_linpot.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pao_param_linpot.mod' due to: pao_param_linpot.o /build/cp2k-Q381vr/cp2k-8.1/src/pao_param_linpot.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pao_types.mod qs_kind_types.mod atomic_kind_types.mod basis_set_types.mod cp_control_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod mathlib.mod pao_linpot_full.mod pao_linpot_rotinv.mod pao_input.mod kinds.mod base_hooks.mod machine.mod pao_param_fock.mod message_passing.mod pao_potentials.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pao_param_exp.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pao_param_exp.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_environment_types.mod pao_types.mod qs_kind_types.mod base_hooks.mod kinds.mod mathlib.mod pao_potentials.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pao_param_exp.F pao_param_exp.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:19:58 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_param_exp.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_param_exp.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pao_param_exp.mod' due to: pao_param_exp.o /build/cp2k-Q381vr/cp2k-8.1/src/pao_param_exp.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_environment_types.mod pao_types.mod qs_kind_types.mod base_hooks.mod kinds.mod mathlib.mod pao_potentials.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pao_param_gth.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pao_param_gth.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod dm_ls_scf_types.mod qs_environment_types.mod pao_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod base_hooks.mod pao_param_fock.mod kinds.mod arnoldi_api.mod machine.mod iterate_matrix.mod orbital_pointers.mod message_passing.mod pao_potentials.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pao_param_gth.F pao_param_gth.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:20:04 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_param_gth.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_param_gth.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pao_param_gth.mod' due to: pao_param_gth.o /build/cp2k-Q381vr/cp2k-8.1/src/pao_param_gth.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod dm_ls_scf_types.mod qs_environment_types.mod pao_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod base_hooks.mod pao_param_fock.mod kinds.mod arnoldi_api.mod machine.mod iterate_matrix.mod orbital_pointers.mod message_passing.mod pao_potentials.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pao_param.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pao_param.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod qs_environment_types.mod pao_types.mod base_hooks.mod kinds.mod cp_log_handling.mod pao_param_linpot.mod pao_param_exp.mod pao_input.mod message_passing.mod pao_param_gth.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pao_param.F pao_param.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:20:09 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_param.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_param.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pao_param.mod' due to: pao_param.o /build/cp2k-Q381vr/cp2k-8.1/src/pao_param.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod qs_environment_types.mod pao_types.mod base_hooks.mod kinds.mod cp_log_handling.mod pao_param_linpot.mod pao_param_exp.mod pao_input.mod message_passing.mod pao_param_gth.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'dm_ls_scf_qs.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_qs.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod pw_types.mod cp_control_types.mod qs_energy_types.mod qs_rho_types.mod qs_rho_atom_types.mod qs_subsys_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod qs_density_mixing_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod particle_list_types.mod cp_dbcsr_cp2k_link.mod pw_methods.mod input_constants.mod cp_realspace_grid_cube.mod kinds.mod qs_rho_methods.mod qs_collocate_density.mod qs_initial_guess.mod base_hooks.mod cp_log_handling.mod qs_ks_methods.mod qs_gspace_mixing.mod qs_mixing_utils.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_qs.F dm_ls_scf_qs.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:20:12 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dm_ls_scf_qs.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dm_ls_scf_qs.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'dm_ls_scf_qs.mod' due to: dm_ls_scf_qs.o /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_qs.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod pw_types.mod cp_control_types.mod qs_energy_types.mod qs_rho_types.mod qs_rho_atom_types.mod qs_subsys_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod qs_density_mixing_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod particle_list_types.mod cp_dbcsr_cp2k_link.mod pw_methods.mod input_constants.mod cp_realspace_grid_cube.mod kinds.mod qs_rho_methods.mod qs_collocate_density.mod qs_initial_guess.mod base_hooks.mod cp_log_handling.mod qs_ks_methods.mod qs_gspace_mixing.mod qs_mixing_utils.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'dm_ls_scf_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod arnoldi_api.mod dm_ls_scf_qs.mod machine.mod iterate_matrix.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_methods.F dm_ls_scf_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:20:17 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dm_ls_scf_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dm_ls_scf_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_methods.F:1372:79: 1372 | xr = (xr*xr)*(4*xr - 3*xr*xr) + gamma_values(k)*xr*xr*((1 - xr)**2) | ^ Warning: ‘scaled_lumo_bound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_methods.F:755:89: 755 | mu_a, mu_b, mu_c, mu_fa, mu_fc, occ_matrix, scaled_homo_bound, scaled_lumo_bound, t1, t2, & | ^ note: ‘scaled_lumo_bound’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_methods.F:1372:79: 1372 | xr = (xr*xr)*(4*xr - 3*xr*xr) + gamma_values(k)*xr*xr*((1 - xr)**2) | ^ Warning: ‘scaled_homo_bound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_methods.F:755:70: 755 | mu_a, mu_b, mu_c, mu_fa, mu_fc, occ_matrix, scaled_homo_bound, scaled_lumo_bound, t1, t2, & | ^ note: ‘scaled_homo_bound’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_methods.F:440:19: 440 | IF (ABS(mu_high - mu_low) < threshold) EXIT | ^ Warning: ‘mu_low’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_methods.F:440:19: Warning: ‘mu_high’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'dm_ls_scf_methods.mod' due to: dm_ls_scf_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod arnoldi_api.mod dm_ls_scf_qs.mod machine.mod iterate_matrix.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pao_ml_neuralnet.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml_neuralnet.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pao_types.mod parallel_rng_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml_neuralnet.F pao_ml_neuralnet.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:20:20 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_ml_neuralnet.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_ml_neuralnet.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pao_ml_neuralnet.mod' due to: pao_ml_neuralnet.o /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml_neuralnet.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pao_types.mod parallel_rng_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pao_io.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pao_io.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod pao_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pao_input.mod kinds.mod cp_output_handling.mod pao_param.mod base_hooks.mod physcon.mod cp_files.mod cp_log_handling.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pao_io.F pao_io.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:20:22 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_io.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_io.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pao_io.mod' due to: pao_io.o /build/cp2k-Q381vr/cp2k-8.1/src/pao_io.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod pao_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pao_input.mod kinds.mod cp_output_handling.mod pao_param.mod base_hooks.mod physcon.mod cp_files.mod cp_log_handling.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pao_ml_gaussprocess.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml_gaussprocess.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pao_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml_gaussprocess.F pao_ml_gaussprocess.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:20:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_ml_gaussprocess.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_ml_gaussprocess.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pao_ml_gaussprocess.mod' due to: pao_ml_gaussprocess.o /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml_gaussprocess.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pao_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pao_ml_descriptor.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml_descriptor.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod pao_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod base_hooks.mod kinds.mod mathlib.mod util.mod mathconstants.mod pao_input.mod pao_potentials.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml_descriptor.F pao_ml_descriptor.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:20:28 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_ml_descriptor.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_ml_descriptor.F90 /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml_descriptor.F:316:100: 316 | block_M(:, :) = block_M(:, :) + w*MATMUL(S_evecs(:, k:k), TRANSPOSE(S_evecs(:, k:k))) | ^ Warning: ‘block_m.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml_descriptor.F:214:67: 214 | REAL(dp), ALLOCATABLE, DIMENSION(:, :) :: block_M, block_S, S_evecs | ^ note: ‘block_m.dim[1].ubound’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml_descriptor.F:214:67: Warning: ‘block_m.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml_descriptor.F:214:67: Warning: ‘block_m.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml_descriptor.F:214:67: Warning: ‘block_m.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml_descriptor.F:111:67: 111 | REAL(dp), ALLOCATABLE, DIMENSION(:, :) :: block_M, block_V, V_evecs | ^ Warning: ‘block_m.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml_descriptor.F:111:67: Warning: ‘block_m.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml_descriptor.F:111:67: Warning: ‘block_m.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml_descriptor.F:111:67: Warning: ‘block_m.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pao_ml_descriptor.mod' due to: pao_ml_descriptor.o /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml_descriptor.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod pao_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod base_hooks.mod kinds.mod mathlib.mod util.mod mathconstants.mod pao_input.mod pao_potentials.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pao_ml.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod qs_environment_types.mod pao_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod base_hooks.mod kinds.mod pao_ml_neuralnet.mod machine.mod pao_input.mod pao_io.mod message_passing.mod pao_ml_gaussprocess.mod pao_ml_descriptor.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml.F pao_ml.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:20:32 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_ml.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_ml.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pao_ml.mod' due to: pao_ml.o /build/cp2k-Q381vr/cp2k-8.1/src/pao_ml.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod qs_environment_types.mod pao_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod base_hooks.mod kinds.mod pao_ml_neuralnet.mod machine.mod pao_input.mod pao_io.mod message_passing.mod pao_ml_gaussprocess.mod pao_ml_descriptor.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pao_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pao_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod pao_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod basis_set_types.mod cp_control_types.mod qs_energy_types.mod qs_rho_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod mathlib.mod kinds.mod bibliography.mod pao_param.mod dm_ls_scf_methods.mod qs_rho_methods.mod qs_initial_guess.mod base_hooks.mod machine.mod ao_util.mod cp_log_handling.mod qs_ks_methods.mod dm_ls_scf_qs.mod iterate_matrix.mod message_passing.mod pao_ml.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pao_methods.F pao_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:20:36 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/pao_methods.F:1023:32: 1023 | block_X(i, j) = old_Xij | ^ Warning: ‘old_xij’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/pao_methods.F:975:54: 975 | delta = ABS(Gij_num - block_G(i, j)) | ^ Warning: ‘gij_num’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pao_methods.mod' due to: pao_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/pao_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod pao_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod basis_set_types.mod cp_control_types.mod qs_energy_types.mod qs_rho_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod mathlib.mod kinds.mod bibliography.mod pao_param.mod dm_ls_scf_methods.mod qs_rho_methods.mod qs_initial_guess.mod base_hooks.mod machine.mod ao_util.mod cp_log_handling.mod qs_ks_methods.mod dm_ls_scf_qs.mod iterate_matrix.mod message_passing.mod pao_ml.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pao_main.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pao_main.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod qs_environment_types.mod pao_types.mod input_section_types.mod base_hooks.mod cp_external_control.mod kinds.mod pao_optimizer.mod pao_methods.mod bibliography.mod machine.mod pao_input.mod pao_param.mod pao_io.mod linesearch.mod pao_ml.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pao_main.F pao_main.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:20:43 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_main.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_main.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pao_main.mod' due to: pao_main.o /build/cp2k-Q381vr/cp2k-8.1/src/pao_main.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod qs_environment_types.mod pao_types.mod input_section_types.mod base_hooks.mod cp_external_control.mod kinds.mod pao_optimizer.mod pao_methods.mod bibliography.mod machine.mod pao_input.mod pao_param.mod pao_io.mod linesearch.mod pao_ml.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pexsi_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pexsi_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pexsi_types.mod dm_ls_scf_types.mod qs_energy_types.mod qs_environment_types.mod qs_ks_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod arnoldi_api.mod cp_dbcsr_cp2k_link.mod dm_ls_scf_qs.mod message_passing.mod pexsi_interface.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pexsi_methods.F pexsi_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:20:46 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pexsi_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pexsi_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pexsi_methods.mod' due to: pexsi_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/pexsi_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pexsi_types.mod dm_ls_scf_types.mod qs_energy_types.mod qs_environment_types.mod qs_ks_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod arnoldi_api.mod cp_dbcsr_cp2k_link.mod dm_ls_scf_qs.mod message_passing.mod pexsi_interface.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'dm_ls_scf_create.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_create.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pexsi_types.mod dm_ls_scf_types.mod cp_control_types.mod particle_types.mod input_enumeration_types.mod molecule_types.mod input_section_types.mod qs_environment_types.mod qs_density_mixing_types.mod input_keyword_types.mod pao_main.mod pexsi_methods.mod input_constants.mod kinds.mod bibliography.mod cp_para_env.mod base_hooks.mod machine.mod cp_log_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_create.F dm_ls_scf_create.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:20:49 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dm_ls_scf_create.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dm_ls_scf_create.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'dm_ls_scf_create.mod' due to: dm_ls_scf_create.o /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_create.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pexsi_types.mod dm_ls_scf_types.mod cp_control_types.mod particle_types.mod input_enumeration_types.mod molecule_types.mod input_section_types.mod qs_environment_types.mod qs_density_mixing_types.mod input_keyword_types.mod pao_main.mod pexsi_methods.mod input_constants.mod kinds.mod bibliography.mod cp_para_env.mod base_hooks.mod machine.mod cp_log_handling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'distribution_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/distribution_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod basis_set_types.mod distribution_2d_types.mod particle_types.mod molecule_types.mod input_section_types.mod distribution_1d_types.mod parallel_rng_types.mod mathlib.mod cp_array_utils.mod input_constants.mod kinds.mod cp_blacs_env.mod cp_output_handling.mod base_hooks.mod util.mod mathconstants.mod machine.mod cp_log_handling.mod cp_min_heap.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/distribution_methods.F distribution_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:21:03 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"distribution_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' distribution_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'distribution_methods.mod' due to: distribution_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/distribution_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod basis_set_types.mod distribution_2d_types.mod particle_types.mod molecule_types.mod input_section_types.mod distribution_1d_types.mod parallel_rng_types.mod mathlib.mod cp_array_utils.mod input_constants.mod kinds.mod cp_blacs_env.mod cp_output_handling.mod base_hooks.mod util.mod mathconstants.mod machine.mod cp_log_handling.mod cp_min_heap.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_environment_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_environment_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod pw_types.mod cp_control_types.mod qs_charges_types.mod distribution_2d_types.mod particle_types.mod molecule_types.mod ewald_environment_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_rho0_types.mod pw_env_types.mod ewald_pw_types.mod qs_matrix_pools.mod pw_env_methods.mod input_constants.mod kinds.mod cp_blacs_env.mod base_hooks.mod ewald_pw_methods.mod distribution_methods.mod qs_rho0_ggrid.mod cp_dbcsr_operations.mod qs_outer_scf.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_environment_methods.F qs_environment_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:21:11 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_environment_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_environment_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_environment_methods.mod' due to: qs_environment_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_environment_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod pw_types.mod cp_control_types.mod qs_charges_types.mod distribution_2d_types.mod particle_types.mod molecule_types.mod ewald_environment_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_rho0_types.mod pw_env_types.mod ewald_pw_types.mod qs_matrix_pools.mod pw_env_methods.mod input_constants.mod kinds.mod cp_blacs_env.mod base_hooks.mod ewald_pw_methods.mod distribution_methods.mod qs_rho0_ggrid.mod cp_dbcsr_operations.mod qs_outer_scf.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'topology_connectivity_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/topology_connectivity_util.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_field_kind_types.mod topology_types.mod molecule_types.mod molecule_kind_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod util.mod memory_utilities.mod cp_output_handling.mod input_constants.mod string_table.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/topology_connectivity_util.F topology_connectivity_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:21:15 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_connectivity_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_connectivity_util.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'topology_connectivity_util.mod' due to: topology_connectivity_util.o /build/cp2k-Q381vr/cp2k-8.1/src/topology_connectivity_util.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_field_kind_types.mod topology_types.mod molecule_types.mod molecule_kind_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod util.mod memory_utilities.mod cp_output_handling.mod input_constants.mod string_table.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mm_mapping_library.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mm_mapping_library.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mm_mapping_library.F mm_mapping_library.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:21:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mm_mapping_library.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mm_mapping_library.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mm_mapping_library.mod' due to: mm_mapping_library.o /build/cp2k-Q381vr/cp2k-8.1/src/mm_mapping_library.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'graphcon.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/graphcon.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/graphcon.F graphcon.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:21:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"graphcon.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' graphcon.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'graphcon.mod' due to: graphcon.o /build/cp2k-Q381vr/cp2k-8.1/src/graphcon.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod util.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'topology_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/topology_util.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types_low.mod topology_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod util.mod mm_mapping_library.mod cp_output_handling.mod string_utilities.mod graphcon.mod periodic_table.mod string_table.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/topology_util.F topology_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:21:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_util.F90 /build/cp2k-Q381vr/cp2k-8.1/src/topology_util.F:977:61: 977 | upper_sym_1 = id2str(atom_info%id_element(iatom)) | 1 Warning: CHARACTER expression will be truncated in assignment (2/80) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'topology_util.mod' due to: topology_util.o /build/cp2k-Q381vr/cp2k-8.1/src/topology_util.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types_low.mod topology_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod util.mod mm_mapping_library.mod cp_output_handling.mod string_utilities.mod graphcon.mod periodic_table.mod string_table.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'topology_coordinate_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/topology_coordinate_util.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 exclusion_types.mod qmmm_types_low.mod external_potential_types.mod particle_types.mod atomic_kind_types.mod topology_types.mod molecule_types.mod molecule_kind_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod memory_utilities.mod cp_output_handling.mod topology_util.mod input_constants.mod string_table.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/topology_coordinate_util.F topology_coordinate_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:21:31 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_coordinate_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_coordinate_util.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'topology_coordinate_util.mod' due to: topology_coordinate_util.o /build/cp2k-Q381vr/cp2k-8.1/src/topology_coordinate_util.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 exclusion_types.mod qmmm_types_low.mod external_potential_types.mod particle_types.mod atomic_kind_types.mod topology_types.mod molecule_types.mod molecule_kind_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod memory_utilities.mod cp_output_handling.mod topology_util.mod input_constants.mod string_table.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'topology_pdb.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/topology_pdb.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod cp_parser_types.mod topology_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp2k_info.mod physcon.mod memory_utilities.mod cp_units.mod cp_output_handling.mod input_constants.mod qmmm_ff_fist.mod cp_parser_methods.mod string_table.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/topology_pdb.F topology_pdb.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:21:37 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_pdb.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_pdb.F90 /build/cp2k-Q381vr/cp2k-8.1/src/topology_pdb.F:317:63: 317 | my_local=.FALSE.) | 1 Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'topology_pdb.mod' due to: topology_pdb.o /build/cp2k-Q381vr/cp2k-8.1/src/topology_pdb.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod cp_parser_types.mod topology_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp2k_info.mod physcon.mod memory_utilities.mod cp_units.mod cp_output_handling.mod input_constants.mod qmmm_ff_fist.mod cp_parser_methods.mod string_table.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmm_topology_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_topology_util.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types_low.mod topology_types.mod molecule_types.mod molecule_kind_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_output_handling.mod string_utilities.mod string_table.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_topology_util.F qmmm_topology_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:21:38 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_topology_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_topology_util.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmm_topology_util.mod' due to: qmmm_topology_util.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_topology_util.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types_low.mod topology_types.mod molecule_types.mod molecule_kind_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_output_handling.mod string_utilities.mod string_table.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'topology_generate_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/topology_generate_util.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod fist_neighbor_list_types.mod cell_types.mod topology_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qmmm_types_low.mod mathlib.mod string_utilities.mod input_constants.mod kinds.mod cp_output_handling.mod periodic_table.mod string_table.mod base_hooks.mod util.mod fist_neighbor_lists.mod cp_units.mod cp_log_handling.mod memory_utilities.mod topology_util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/topology_generate_util.F topology_generate_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:21:39 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_generate_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_generate_util.F90 /build/cp2k-Q381vr/cp2k-8.1/src/topology_generate_util.F:1897:59: 1897 | atm_symbol = id2str(atom_info%id_element(i)) | 1 Warning: CHARACTER expression will be truncated in assignment (2/80) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/topology_generate_util.F:630:58: 630 | upper_sym_1 = id2str(atom_info%id_element(iatom)) | 1 Warning: CHARACTER expression will be truncated in assignment (2/80) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/topology_generate_util.F:1656:34: 1656 | ind = wrk(i)%array1(j) | ^ Warning: ‘wrk.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/topology_generate_util.F:1656:34: Warning: ‘wrk.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/topology_generate_util.F:1656:34: Warning: ‘wrk.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/topology_generate_util.F:1178:22: 1178 | IF (do_it > 0) THEN | ^ Warning: ‘do_it’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/topology_generate_util.F:764:35: 764 | rbond2 = rbond*rbond | ^ Warning: ‘rbond’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/topology_generate_util.F:498:101: 498 | atom_info%map_mol_typ(ilast + 1), atom_info%map_mol_num(ilast + 1)) | ^ Warning: ‘ilast’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'topology_generate_util.mod' due to: topology_generate_util.o /build/cp2k-Q381vr/cp2k-8.1/src/topology_generate_util.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod fist_neighbor_list_types.mod cell_types.mod topology_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qmmm_types_low.mod mathlib.mod string_utilities.mod input_constants.mod kinds.mod cp_output_handling.mod periodic_table.mod string_table.mod base_hooks.mod util.mod fist_neighbor_lists.mod cp_units.mod cp_log_handling.mod memory_utilities.mod topology_util.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'topology_cp2k.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/topology_cp2k.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_types.mod input_section_types.mod topology_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod memory_utilities.mod cp_units.mod cp_output_handling.mod periodic_table.mod cp_parser_methods.mod string_table.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/topology_cp2k.F topology_cp2k.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:21:48 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_cp2k.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_cp2k.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'topology_cp2k.mod' due to: topology_cp2k.o /build/cp2k-Q381vr/cp2k-8.1/src/topology_cp2k.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_types.mod input_section_types.mod topology_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod memory_utilities.mod cp_units.mod cp_output_handling.mod periodic_table.mod cp_parser_methods.mod string_table.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'topology_cif.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/topology_cif.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_types.mod input_section_types.mod topology_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_parser_methods.mod memory_utilities.mod fparser.mod cp_output_handling.mod string_utilities.mod cell_methods.mod string_table.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/topology_cif.F topology_cif.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:21:49 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_cif.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_cif.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'topology_cif.mod' due to: topology_cif.o /build/cp2k-Q381vr/cp2k-8.1/src/topology_cif.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_types.mod input_section_types.mod topology_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_parser_methods.mod memory_utilities.mod fparser.mod cp_output_handling.mod string_utilities.mod cell_methods.mod string_table.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_restarts_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_restarts_util.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_linked_list_input.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_restarts_util.F input_cp2k_restarts_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:21:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_restarts_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_restarts_util.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_restarts_util.mod' due to: input_cp2k_restarts_util.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_restarts_util.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_linked_list_input.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'topology_gromos.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/topology_gromos.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod topology_types.mod cp_parser_types.mod base_hooks.mod input_cp2k_restarts_util.mod cp_log_handling.mod kinds.mod cp_parser_methods.mod memory_utilities.mod cp_output_handling.mod cp_units.mod string_table.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/topology_gromos.F topology_gromos.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:21:51 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_gromos.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_gromos.F90 /build/cp2k-Q381vr/cp2k-8.1/src/topology_gromos.F:280:21: 280 | nsolute = natom | ^ Warning: ‘natom’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'topology_gromos.mod' due to: topology_gromos.o /build/cp2k-Q381vr/cp2k-8.1/src/topology_gromos.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod topology_types.mod cp_parser_types.mod base_hooks.mod input_cp2k_restarts_util.mod cp_log_handling.mod kinds.mod cp_parser_methods.mod memory_utilities.mod cp_output_handling.mod cp_units.mod string_table.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'topology_xyz.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/topology_xyz.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod topology_types.mod cp_parser_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_parser_methods.mod memory_utilities.mod cp_output_handling.mod periodic_table.mod cp_units.mod string_table.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/topology_xyz.F topology_xyz.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:21:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_xyz.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_xyz.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'topology_xyz.mod' due to: topology_xyz.o /build/cp2k-Q381vr/cp2k-8.1/src/topology_xyz.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod topology_types.mod cp_parser_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_parser_methods.mod memory_utilities.mod cp_output_handling.mod periodic_table.mod cp_units.mod string_table.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'force_fields_input.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/force_fields_input.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod force_field_kind_types.mod shell_potential_types.mod cp_parser_types.mod pair_potential_types.mod input_section_types.mod damping_dipole_types.mod cp_para_types.mod force_field_types.mod mathlib.mod string_utilities.mod cp_linked_list_input.mod kinds.mod bibliography.mod cp_output_handling.mod force_fields_util.mod base_hooks.mod mathconstants.mod cp_units.mod cp_log_handling.mod memory_utilities.mod cp_parser_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/force_fields_input.F force_fields_input.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:21:55 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_fields_input.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_fields_input.F90 /build/cp2k-Q381vr/cp2k-8.1/src/force_fields_input.F:1289:71: 1289 | nonbonded%pot(start + isec)%pot%set(1)%gal%met1 = atm_names(1) | 1 Warning: CHARACTER expression will be truncated in assignment (2/80) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/force_fields_input.F:1290:71: 1290 | nonbonded%pot(start + isec)%pot%set(1)%gal%met2 = atm_names(2) | 1 Warning: CHARACTER expression will be truncated in assignment (2/80) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'force_fields_input.mod' due to: force_fields_input.o /build/cp2k-Q381vr/cp2k-8.1/src/force_fields_input.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod force_field_kind_types.mod shell_potential_types.mod cp_parser_types.mod pair_potential_types.mod input_section_types.mod damping_dipole_types.mod cp_para_types.mod force_field_types.mod mathlib.mod string_utilities.mod cp_linked_list_input.mod kinds.mod bibliography.mod cp_output_handling.mod force_fields_util.mod base_hooks.mod mathconstants.mod cp_units.mod cp_log_handling.mod memory_utilities.mod cp_parser_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'topology_psf.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/topology_psf.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod topology_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod force_fields_input.mod cp_log_handling.mod kinds.mod cp_parser_methods.mod util.mod memory_utilities.mod cp_output_handling.mod string_utilities.mod topology_util.mod input_constants.mod qmmm_ff_fist.mod string_table.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/topology_psf.F topology_psf.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:22:00 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_psf.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_psf.F90 /build/cp2k-Q381vr/cp2k-8.1/src/topology_psf.F:780:81: 780 | extension=".psf", my_local=.FALSE.) | 1 Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'topology_psf.mod' due to: topology_psf.o /build/cp2k-Q381vr/cp2k-8.1/src/topology_psf.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod topology_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod force_fields_input.mod cp_log_handling.mod kinds.mod cp_parser_methods.mod util.mod memory_utilities.mod cp_output_handling.mod string_utilities.mod topology_util.mod input_constants.mod qmmm_ff_fist.mod string_table.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'topology_input.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/topology_input.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod topology_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_log_handling.mod memory_utilities.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/topology_input.F topology_input.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:22:04 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_input.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_input.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'topology_input.mod' due to: topology_input.o /build/cp2k-Q381vr/cp2k-8.1/src/topology_input.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod topology_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_log_handling.mod memory_utilities.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'topology_amber.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/topology_amber.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod force_field_types.mod particle_types.mod input_section_types.mod topology_types.mod cp_parser_types.mod base_hooks.mod input_cp2k_restarts_util.mod cp_log_handling.mod kinds.mod cp_parser_methods.mod topology_generate_util.mod util.mod memory_utilities.mod cp_output_handling.mod qmmm_ff_fist.mod cp_units.mod string_table.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/topology_amber.F topology_amber.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:22:07 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_amber.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_amber.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'topology_amber.mod' due to: topology_amber.o /build/cp2k-Q381vr/cp2k-8.1/src/topology_amber.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod force_field_types.mod particle_types.mod input_section_types.mod topology_types.mod cp_parser_types.mod base_hooks.mod input_cp2k_restarts_util.mod cp_log_handling.mod kinds.mod cp_parser_methods.mod topology_generate_util.mod util.mod memory_utilities.mod cp_output_handling.mod qmmm_ff_fist.mod cp_units.mod string_table.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'topology_xtl.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/topology_xtl.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_types.mod input_section_types.mod topology_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_parser_methods.mod mathlib.mod memory_utilities.mod cp_units.mod cp_output_handling.mod cell_methods.mod string_table.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/topology_xtl.F topology_xtl.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:22:14 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_xtl.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_xtl.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'topology_xtl.mod' due to: topology_xtl.o /build/cp2k-Q381vr/cp2k-8.1/src/topology_xtl.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_types.mod input_section_types.mod topology_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_parser_methods.mod mathlib.mod memory_utilities.mod cp_units.mod cp_output_handling.mod cell_methods.mod string_table.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'topology_multiple_unit_cell.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/topology_multiple_unit_cell.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod topology_types.mod cell_types.mod base_hooks.mod kinds.mod memory_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/topology_multiple_unit_cell.F topology_multiple_unit_cell.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:22:15 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_multiple_unit_cell.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_multiple_unit_cell.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'topology_multiple_unit_cell.mod' due to: topology_multiple_unit_cell.o /build/cp2k-Q381vr/cp2k-8.1/src/topology_multiple_unit_cell.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod topology_types.mod cell_types.mod base_hooks.mod kinds.mod memory_utilities.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'topology_constraint_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/topology_constraint_util.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod input_section_types.mod molecule_types.mod qmmm_types_low.mod particle_types.mod atomic_kind_types.mod topology_types.mod molecule_kind_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod qmmm_ff_fist.mod memory_utilities.mod cp_output_handling.mod input_constants.mod colvar_utils.mod colvar_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/topology_constraint_util.F topology_constraint_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:22:16 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_constraint_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_constraint_util.F90 /build/cp2k-Q381vr/cp2k-8.1/src/topology_constraint_util.F:751:96: 751 | fixd_list(kk)%restraint%active = cons_info%fixed_mol_restraint(k1loc) | ^ Warning: ‘k1loc’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/topology_constraint_util.F:101:77: 101 | INTEGER :: cind, first, first_atom, gind, handle, handle2, i, ii, itype, iw, j, k, k1loc, & | ^ Warning: ‘itype’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'topology_constraint_util.mod' due to: topology_constraint_util.o /build/cp2k-Q381vr/cp2k-8.1/src/topology_constraint_util.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod input_section_types.mod molecule_types.mod qmmm_types_low.mod particle_types.mod atomic_kind_types.mod topology_types.mod molecule_kind_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod qmmm_ff_fist.mod memory_utilities.mod cp_output_handling.mod input_constants.mod colvar_utils.mod colvar_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'topology.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/topology.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod exclusion_types.mod topology_types.mod particle_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod qmmm_types_low.mod input_cp2k_binary_restarts.mod topology_connectivity_util.mod topology_pdb.mod input_constants.mod qmmm_topology_util.mod kinds.mod topology_generate_util.mod topology_cp2k.mod topology_cif.mod cp_output_handling.mod topology_gromos.mod topology_xyz.mod colvar_utils.mod topology_coordinate_util.mod topology_psf.mod string_table.mod base_hooks.mod mm_mapping_library.mod topology_input.mod topology_amber.mod atoms_input.mod topology_xtl.mod cell_methods.mod cp_log_handling.mod topology_multiple_unit_cell.mod topology_util.mod topology_constraint_util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/topology.F topology.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:22:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'topology.mod' due to: topology.o /build/cp2k-Q381vr/cp2k-8.1/src/topology.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod exclusion_types.mod topology_types.mod particle_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod qmmm_types_low.mod input_cp2k_binary_restarts.mod topology_connectivity_util.mod topology_pdb.mod input_constants.mod qmmm_topology_util.mod kinds.mod topology_generate_util.mod topology_cp2k.mod topology_cif.mod cp_output_handling.mod topology_gromos.mod topology_xyz.mod colvar_utils.mod topology_coordinate_util.mod topology_psf.mod string_table.mod base_hooks.mod mm_mapping_library.mod topology_input.mod topology_amber.mod atoms_input.mod topology_xtl.mod cell_methods.mod cp_log_handling.mod topology_multiple_unit_cell.mod topology_util.mod topology_constraint_util.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_subsys_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/cp_subsys_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod exclusion_types.mod cp_result_types.mod virial_types.mod atomic_kind_list_types.mod topology_types.mod atprop_types.mod particle_types.mod molecule_types.mod input_section_types.mod molecule_list_types.mod cp_subsys_types.mod cp_para_types.mod qmmm_types_low.mod particle_list_types.mod topology_connectivity_util.mod input_constants.mod kinds.mod topology_coordinate_util.mod topology.mod string_table.mod cp_para_env.mod base_hooks.mod topology_util.mod colvar_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/cp_subsys_methods.F cp_subsys_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:22:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_subsys_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_subsys_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_subsys_methods.mod' due to: cp_subsys_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/cp_subsys_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod exclusion_types.mod cp_result_types.mod virial_types.mod atomic_kind_list_types.mod topology_types.mod atprop_types.mod particle_types.mod molecule_types.mod input_section_types.mod molecule_list_types.mod cp_subsys_types.mod cp_para_types.mod qmmm_types_low.mod particle_list_types.mod topology_connectivity_util.mod input_constants.mod kinds.mod topology_coordinate_util.mod topology.mod string_table.mod cp_para_env.mod base_hooks.mod topology_util.mod colvar_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_subsys_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_subsys_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atom_types.mod cp_para_types.mod cp_subsys_types.mod qs_subsys_types.mod external_potential_types.mod qs_kind_types.mod atomic_kind_types.mod input_section_types.mod molecule_kind_types.mod cell_types.mod base_hooks.mod kinds.mod cp_subsys_methods.mod cell_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_subsys_methods.F qs_subsys_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:22:28 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_subsys_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_subsys_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_subsys_methods.mod' due to: qs_subsys_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_subsys_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atom_types.mod cp_para_types.mod cp_subsys_types.mod qs_subsys_types.mod external_potential_types.mod qs_kind_types.mod atomic_kind_types.mod input_section_types.mod molecule_kind_types.mod cell_types.mod base_hooks.mod kinds.mod cp_subsys_methods.mod cell_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_dftb_parameters.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_parameters.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cp_control_types.mod cp_parser_types.mod qs_dftb_types.mod input_section_types.mod cp_para_types.mod external_potential_types.mod string_utilities.mod input_constants.mod kinds.mod qs_dftb_utils.mod cp_output_handling.mod base_hooks.mod mathconstants.mod physcon.mod cp_files.mod qmmm_ff_fist.mod cp_log_handling.mod message_passing.mod cp_parser_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_parameters.F qs_dftb_parameters.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:22:30 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dftb_parameters.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dftb_parameters.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_dftb_parameters.mod' due to: qs_dftb_parameters.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_dftb_parameters.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cp_control_types.mod cp_parser_types.mod qs_dftb_types.mod input_section_types.mod cp_para_types.mod external_potential_types.mod string_utilities.mod input_constants.mod kinds.mod qs_dftb_utils.mod cp_output_handling.mod base_hooks.mod mathconstants.mod physcon.mod cp_files.mod qmmm_ff_fist.mod cp_log_handling.mod message_passing.mod cp_parser_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mp2_setup.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mp2_setup.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod cp_eri_mme_interface.mod cp_output_handling.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mp2_setup.F mp2_setup.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:22:34 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_setup.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_setup.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mp2_setup.mod' due to: mp2_setup.o /build/cp2k-Q381vr/cp2k-8.1/src/mp2_setup.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod cp_eri_mme_interface.mod cp_output_handling.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ai_spin_orbit.mod' due to: ai_spin_orbit.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_spin_orbit.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_spin_orbit.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod qs_environment_types.mod block_p_types.mod qs_neighbor_list_types.mod particle_types.mod qs_kind_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod ai_spin_orbit.mod cp_dbcsr_output.mod cp_output_handling.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_spin_orbit.F qs_spin_orbit.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:22:35 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_spin_orbit.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_spin_orbit.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_spin_orbit.F:195:13: 195 | IF (jatom /= last_jatom) THEN | ^ Warning: ‘last_jatom’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_spin_orbit.mod' due to: qs_spin_orbit.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_spin_orbit.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod qs_environment_types.mod block_p_types.mod qs_neighbor_list_types.mod particle_types.mod qs_kind_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod ai_spin_orbit.mod cp_dbcsr_output.mod cp_output_handling.mod orbital_pointers.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ai_fermi_contact.mod' due to: ai_fermi_contact.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_fermi_contact.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_fermi_contact.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod qs_environment_types.mod block_p_types.mod qs_neighbor_list_types.mod particle_types.mod qs_kind_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_dbcsr_output.mod cp_output_handling.mod orbital_pointers.mod ai_fermi_contact.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_fermi_contact.F qs_fermi_contact.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:22:37 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fermi_contact.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fermi_contact.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_fermi_contact.F:195:13: 195 | IF (jatom /= last_jatom) THEN | ^ Warning: ‘last_jatom’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_fermi_contact.mod' due to: qs_fermi_contact.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_fermi_contact.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod qs_environment_types.mod block_p_types.mod qs_neighbor_list_types.mod particle_types.mod qs_kind_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_dbcsr_output.mod cp_output_handling.mod orbital_pointers.mod ai_fermi_contact.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ai_elec_field.mod' due to: ai_elec_field.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_elec_field.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_elec_field.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod qs_environment_types.mod block_p_types.mod qs_neighbor_list_types.mod particle_types.mod qs_kind_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod ai_elec_field.mod cp_dbcsr_output.mod cp_output_handling.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_elec_field.F qs_elec_field.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:22:40 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_elec_field.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_elec_field.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_elec_field.F:198:13: 198 | IF (jatom /= last_jatom) THEN | ^ Warning: ‘last_jatom’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_elec_field.mod' due to: qs_elec_field.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_elec_field.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod qs_environment_types.mod block_p_types.mod qs_neighbor_list_types.mod particle_types.mod qs_kind_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod ai_elec_field.mod cp_dbcsr_output.mod cp_output_handling.mod orbital_pointers.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_linres_op.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_op.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod qs_linres_types.mod particle_types.mod cp_cfm_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_dbcsr_cp2k_link.mod cp_array_utils.mod cp_fm_struct.mod qs_moments.mod qs_spin_orbit.mod particle_methods.mod kinds.mod qs_fermi_contact.mod cp_output_handling.mod qs_elec_field.mod cp_cfm_basic_linalg.mod base_hooks.mod qs_operators_ao.mod mathconstants.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_log_handling.mod orbital_pointers.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_op.F qs_linres_op.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:22:43 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_op.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_op.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_linres_op.mod' due to: qs_linres_op.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_op.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod qs_linres_types.mod particle_types.mod cp_cfm_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_dbcsr_cp2k_link.mod cp_array_utils.mod cp_fm_struct.mod qs_moments.mod qs_spin_orbit.mod particle_methods.mod kinds.mod qs_fermi_contact.mod cp_output_handling.mod qs_elec_field.mod cp_cfm_basic_linalg.mod base_hooks.mod qs_operators_ao.mod mathconstants.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_log_handling.mod orbital_pointers.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_linres_atom_current.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_atom_current.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 sap_kind_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod cp_control_types.mod qs_linres_types.mod qs_rho_atom_types.mod particle_types.mod paw_proj_set_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_oce_types.mod qs_linres_op.mod input_constants.mod kinds.mod base_hooks.mod util.mod qs_grid_atom.mod qs_harmonics_atom.mod qs_oce_methods.mod cp_log_handling.mod orbital_pointers.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_atom_current.F qs_linres_atom_current.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:22:49 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_atom_current.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_atom_current.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_linres_atom_current.mod' due to: qs_linres_atom_current.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_atom_current.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 sap_kind_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod cp_control_types.mod qs_linres_types.mod qs_rho_atom_types.mod particle_types.mod paw_proj_set_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_oce_types.mod qs_linres_op.mod input_constants.mod kinds.mod base_hooks.mod util.mod qs_grid_atom.mod qs_harmonics_atom.mod qs_oce_methods.mod cp_log_handling.mod orbital_pointers.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_linres_current.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_current.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod realspace_grid_types.mod qs_linres_types.mod qs_rho_types.mod task_list_types.mod qs_subsys_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod particle_list_types.mod qs_linres_op.mod cp_dbcsr_cp2k_link.mod cp_array_utils.mod cp_fm_struct.mod qs_matrix_pools.mod pw_methods.mod input_constants.mod particle_methods.mod cp_realspace_grid_cube.mod kinds.mod cp_output_handling.mod base_hooks.mod rs_pw_interface.mod qs_operators_ao.mod mathconstants.mod cp_fm_basic_linalg.mod ao_util.mod task_list_methods.mod cp_log_handling.mod qs_linres_atom_current.mod gaussian_gridlevels.mod memory_utilities.mod cube_utils.mod orbital_pointers.mod grid_api.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_current.F qs_linres_current.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:23:07 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_current.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_current.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_current.F:1289:37: 1289 | END FUNCTION encode_ardbmdarb_func | ^ Warning: ‘func’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_current.F:1262:56: 1262 | FUNCTION encode_ardbmdarb_func(idir, ir) RESULT(func) | ^ note: ‘func’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_current.F:1450:56: 1450 | TYPE(box_type), DIMENSION(:, :, :), POINTER :: box | ^ Warning: ‘MEM[(struct array03_box_type &)&box].dim[2].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_current.F:1450:56: Warning: ‘MEM[(struct array03_box_type &)&box].dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_current.F:1450:56: Warning: ‘MEM[(struct array03_box_type &)&box].dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_current.F:1450:56: Warning: ‘MEM[(struct array03_box_type &)&box].dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_current.F:1450:56: Warning: ‘MEM[(struct array03_box_type &)&box].dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_linres_current.mod' due to: qs_linres_current.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_current.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod realspace_grid_types.mod qs_linres_types.mod qs_rho_types.mod task_list_types.mod qs_subsys_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod particle_list_types.mod qs_linres_op.mod cp_dbcsr_cp2k_link.mod cp_array_utils.mod cp_fm_struct.mod qs_matrix_pools.mod pw_methods.mod input_constants.mod particle_methods.mod cp_realspace_grid_cube.mod kinds.mod cp_output_handling.mod base_hooks.mod rs_pw_interface.mod qs_operators_ao.mod mathconstants.mod cp_fm_basic_linalg.mod ao_util.mod task_list_methods.mod cp_log_handling.mod qs_linres_atom_current.mod gaussian_gridlevels.mod memory_utilities.mod cube_utils.mod orbital_pointers.mod grid_api.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'transport.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/transport.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod pw_types.mod cp_control_types.mod qs_linres_types.mod qs_rho_types.mod qs_subsys_types.mod particle_types.mod transport_env_types.mod input_section_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod particle_list_types.mod cp_dbcsr_cp2k_link.mod pw_methods.mod particle_methods.mod cp_realspace_grid_cube.mod kinds.mod bibliography.mod cp_output_handling.mod base_hooks.mod physcon.mod cp_log_handling.mod qs_linres_current.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/transport.F transport.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:23:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"transport.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' transport.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'transport.mod' due to: transport.o /build/cp2k-Q381vr/cp2k-8.1/src/transport.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod pw_types.mod cp_control_types.mod qs_linres_types.mod qs_rho_types.mod qs_subsys_types.mod particle_types.mod transport_env_types.mod input_section_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod particle_list_types.mod cp_dbcsr_cp2k_link.mod pw_methods.mod particle_methods.mod cp_realspace_grid_cube.mod kinds.mod bibliography.mod cp_output_handling.mod base_hooks.mod physcon.mod cp_log_handling.mod qs_linres_current.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_write_output.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc_write_output.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod input_cp2k_check.mod xc_libxc.mod input_constants.mod xc_derivatives.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc_write_output.F xc_write_output.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:23:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc_write_output.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_write_output.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_write_output.mod' due to: xc_write_output.o /build/cp2k-Q381vr/cp2k-8.1/src/xc_write_output.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod input_cp2k_check.mod xc_libxc.mod input_constants.mod xc_derivatives.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_control_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/cp_control_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod cp_control_types.mod input_enumeration_types.mod pair_potential_types.mod input_section_types.mod input_keyword_types.mod input_cp2k_dft.mod string_utilities.mod xc_write_output.mod input_constants.mod xc_input_constants.mod kinds.mod bibliography.mod input_cp2k_check.mod cp_output_handling.mod periodic_table.mod qs_cdft_utils.mod force_fields_input.mod base_hooks.mod util.mod mathconstants.mod cp_files.mod cp_units.mod cp_log_handling.mod xc_derivatives.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/cp_control_utils.F cp_control_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:23:28 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_control_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_control_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/src/cp_control_utils.F:1677:51: 1677 | method = enum_i2c(enum, qs_control%method_id) | 1 Warning: CHARACTER expression will be truncated in assignment (20/80) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/cp_control_utils.F:1682:69: 1682 | quadrature = enum_i2c(enum, qs_control%gapw_control%quadrature) | 1 Warning: CHARACTER expression will be truncated in assignment (20/80) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/cp_control_utils.F:208:53: 208 | dft_control%auto_basis_aux_fit = isize | ^ Warning: ‘isize’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_control_utils.mod' due to: cp_control_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/cp_control_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod cp_control_types.mod input_enumeration_types.mod pair_potential_types.mod input_section_types.mod input_keyword_types.mod input_cp2k_dft.mod string_utilities.mod xc_write_output.mod input_constants.mod xc_input_constants.mod kinds.mod bibliography.mod input_cp2k_check.mod cp_output_handling.mod periodic_table.mod qs_cdft_utils.mod force_fields_input.mod base_hooks.mod util.mod mathconstants.mod cp_files.mod cp_units.mod cp_log_handling.mod xc_derivatives.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_gcp_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_gcp_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod qs_environment_types.mod qs_gcp_types.mod qs_kind_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod kinds.mod cp_parser_methods.mod mathconstants.mod sto_ng.mod periodic_table.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_gcp_utils.F qs_gcp_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:23:34 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_gcp_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_gcp_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_gcp_utils.mod' due to: qs_gcp_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_gcp_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod qs_environment_types.mod qs_gcp_types.mod qs_kind_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod kinds.mod cp_parser_methods.mod mathconstants.mod sto_ng.mod periodic_table.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_environment.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_environment.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod multipole_types.mod global_types.mod fist_nonbond_env_types.mod qs_force_types.mod rel_control_types.mod xtb_types.mod kpoint_types.mod qs_dispersion_types.mod qs_wf_history_types.mod qs_environment_types.mod ewald_pw_types.mod basis_set_types.mod cp_control_types.mod cp_ddapc_types.mod semi_empirical_mpole_types.mod particle_types.mod qs_mo_types.mod ewald_environment_types.mod cp_subsys_types.mod cp_para_types.mod qmmm_types_low.mod pw_env_types.mod distribution_1d_types.mod hfx_types.mod qs_local_rho_types.mod mp2_types.mod lri_environment_types.mod ec_env_types.mod semi_empirical_store_int_types.mod input_section_types.mod scf_control_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod basis_set_container_types.mod qs_energy_types.mod qs_rho_atom_types.mod qs_subsys_types.mod qs_gcp_types.mod qs_dftb_types.mod et_coupling_types.mod molecule_types.mod qs_rho0_types.mod external_potential_types.mod qs_wf_history_methods.mod header.mod semi_empirical_expns3_methods.mod input_constants.mod almo_scf_env_methods.mod cp_symmetry.mod semi_empirical_int_arrays.mod atom_kind_orbitals.mod ec_environment.mod ewald_pw_methods.mod qs_rho0_methods.mod particle_methods.mod auto_basis.mod cp_blacs_env.mod semi_empirical_utils.mod dm_ls_scf_create.mod mathconstants.mod lri_environment_init.mod qs_environment_methods.mod gamma.mod qs_dispersion_utils.mod bibliography.mod hartree_local_methods.mod cp_para_env.mod qs_interactions.mod qs_subsys_methods.mod orbital_pointers.mod qs_dftb_parameters.mod qs_dispersion_pairpot.mod kpoint_methods.mod mp2_setup.mod xtb_parameters.mod kinds.mod semi_empirical_mpole_methods.mod cp_output_handling.mod transport.mod cp_control_utils.mod qs_gcp_utils.mod base_hooks.mod kg_environment.mod qs_rho_atom_methods.mod machine.mod cp_log_handling.mod distribution_methods.mod orbital_transformation_matrices.mod qs_rho0_ggrid.mod qs_dispersion_nonloc.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_environment.F qs_environment.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:23:36 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_environment.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_environment.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_environment.F:1197:87: 1197 | dispersion_env%parameter_file_name = dftb_control%dispersion_parameter_file | 1 Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/qs_environment.F:1230:83: 1230 | dispersion_env%parameter_file_name = xtb_control%dispersion_parameter_file | 1 Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/qs_environment.F:1260:85: 1260 | dispersion_env%parameter_file_name = se_control%dispersion_parameter_file | 1 Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/qs_environment.F:1222:43: 1222 | dispersion_env%a1 = xtb_control%a1 | ^ Warning: ‘xtb_control’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_environment.F:565:71: 565 | TYPE(xtb_control_type), POINTER :: xtb_control | ^ note: ‘xtb_control’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/qs_environment.F:1184:42: 1184 | IF (dftb_control%dispersion .AND. dftb_control%dispersion_type == dispersion_d3) THEN | ^ Warning: ‘dftb_control’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_environment.F:526:72: 526 | TYPE(dftb_control_type), POINTER :: dftb_control | ^ note: ‘dftb_control’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_environment.mod' due to: qs_environment.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_environment.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod multipole_types.mod global_types.mod fist_nonbond_env_types.mod qs_force_types.mod rel_control_types.mod xtb_types.mod kpoint_types.mod qs_dispersion_types.mod qs_wf_history_types.mod qs_environment_types.mod ewald_pw_types.mod basis_set_types.mod cp_control_types.mod cp_ddapc_types.mod semi_empirical_mpole_types.mod particle_types.mod qs_mo_types.mod ewald_environment_types.mod cp_subsys_types.mod cp_para_types.mod qmmm_types_low.mod pw_env_types.mod distribution_1d_types.mod hfx_types.mod qs_local_rho_types.mod mp2_types.mod lri_environment_types.mod ec_env_types.mod semi_empirical_store_int_types.mod input_section_types.mod scf_control_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod basis_set_container_types.mod qs_energy_types.mod qs_rho_atom_types.mod qs_subsys_types.mod qs_gcp_types.mod qs_dftb_types.mod et_coupling_types.mod molecule_types.mod qs_rho0_types.mod external_potential_types.mod qs_wf_history_methods.mod header.mod semi_empirical_expns3_methods.mod input_constants.mod almo_scf_env_methods.mod cp_symmetry.mod semi_empirical_int_arrays.mod atom_kind_orbitals.mod ec_environment.mod ewald_pw_methods.mod qs_rho0_methods.mod particle_methods.mod auto_basis.mod cp_blacs_env.mod semi_empirical_utils.mod dm_ls_scf_create.mod mathconstants.mod lri_environment_init.mod qs_environment_methods.mod gamma.mod qs_dispersion_utils.mod bibliography.mod hartree_local_methods.mod cp_para_env.mod qs_interactions.mod qs_subsys_methods.mod orbital_pointers.mod qs_dftb_parameters.mod qs_dispersion_pairpot.mod kpoint_methods.mod mp2_setup.mod xtb_parameters.mod kinds.mod semi_empirical_mpole_methods.mod cp_output_handling.mod transport.mod cp_control_utils.mod qs_gcp_utils.mod base_hooks.mod kg_environment.mod qs_rho_atom_methods.mod machine.mod cp_log_handling.mod distribution_methods.mod orbital_transformation_matrices.mod qs_rho0_ggrid.mod qs_dispersion_nonloc.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_gamma2kp.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_gamma2kp.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cp_para_types.mod kpoint_types.mod qs_environment_types.mod qs_scf_types.mod input_section_types.mod base_hooks.mod kinds.mod qs_ks_methods.mod qs_scf_initialization.mod qs_energy_init.mod qs_environment.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_gamma2kp.F qs_gamma2kp.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:23:49 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_gamma2kp.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_gamma2kp.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_gamma2kp.mod' due to: qs_gamma2kp.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_gamma2kp.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cp_para_types.mod kpoint_types.mod qs_environment_types.mod qs_scf_types.mod input_section_types.mod base_hooks.mod kinds.mod qs_ks_methods.mod qs_scf_initialization.mod qs_energy_init.mod qs_environment.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'wannier90.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/wannier90.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod physcon.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/wannier90.F wannier90.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:23:51 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"wannier90.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' wannier90.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'wannier90.mod' due to: wannier90.o /build/cp2k-Q381vr/cp2k-8.1/src/wannier90.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod physcon.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_wannier90.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_wannier90.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod kpoint_types.mod cp_fm_pool_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod qs_matrix_pools.mod kpoint_methods.mod qs_moments.mod kinds.mod qs_gamma2kp.mod cp_blacs_env.mod cp_para_env.mod base_hooks.mod mathconstants.mod physcon.mod machine.mod cp_files.mod cp_gemm_interface.mod cp_log_handling.mod qs_scf_diagonalization.mod wannier90.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_wannier90.F qs_wannier90.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:23:56 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_wannier90.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_wannier90.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_wannier90.mod' due to: qs_wannier90.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_wannier90.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod kpoint_types.mod cp_fm_pool_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod qs_matrix_pools.mod kpoint_methods.mod qs_moments.mod kinds.mod qs_gamma2kp.mod cp_blacs_env.mod cp_para_env.mod base_hooks.mod mathconstants.mod physcon.mod machine.mod cp_files.mod cp_gemm_interface.mod cp_log_handling.mod qs_scf_diagonalization.mod wannier90.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_scf_csr_write.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_csr_write.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 kpoint_types.mod qs_environment_types.mod qs_neighbor_list_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_dbcsr_cp2k_link.mod kpoint_methods.mod cp_output_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_csr_write.F qs_scf_csr_write.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:24:01 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_csr_write.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_csr_write.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_csr_write.F:275:65: 275 | CALL dbcsr_add(cmatrix, tmatrix, cone, ione) | ^ Warning: ‘tmatrix’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_csr_write.F:273:60: 273 | CALL dbcsr_copy(cmatrix, rmatrix_nosym) | ^ Warning: ‘rmatrix_nosym’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_csr_write.F:274:60: 274 | CALL dbcsr_copy(tmatrix, imatrix_nosym) | ^ Warning: ‘imatrix_nosym’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_csr_write.F:272:68: 272 | CALL dbcsr_desymmetrize(imatrix, imatrix_nosym) | ^ Warning: ‘imatrix’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_csr_write.F:278:70: 278 | CALL dbcsr_convert_dbcsr_to_csr(cmatrix, mat_csr) | ^ Warning: ‘cmatrix’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_scf_csr_write.mod' due to: qs_scf_csr_write.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_csr_write.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 kpoint_types.mod qs_environment_types.mod qs_neighbor_list_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_dbcsr_cp2k_link.mod kpoint_methods.mod cp_output_handling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'commutator_rkinetic.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rkinetic.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod base_hooks.mod kinds.mod qs_integral_utils.mod ai_contraction.mod orbital_pointers.mod ai_kinetic.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rkinetic.F commutator_rkinetic.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:24:03 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"commutator_rkinetic.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' commutator_rkinetic.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'commutator_rkinetic.mod' due to: commutator_rkinetic.o /build/cp2k-Q381vr/cp2k-8.1/src/commutator_rkinetic.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod base_hooks.mod kinds.mod qs_integral_utils.mod ai_contraction.mod orbital_pointers.mod ai_kinetic.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_commutators.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_commutators.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_kind_types.mod base_hooks.mod kinds.mod cp_dbcsr_cp2k_link.mod commutator_rkinetic.mod commutator_rpnl.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_commutators.F qs_commutators.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:24:05 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_commutators.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_commutators.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_commutators.mod' due to: qs_commutators.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_commutators.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_kind_types.mod base_hooks.mod kinds.mod cp_dbcsr_cp2k_link.mod commutator_rkinetic.mod commutator_rpnl.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_scf_post_gpw.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_post_gpw.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_types.mod kpoint_types.mod qs_loc_types.mod qs_environment_types.mod basis_set_types.mod cp_control_types.mod preconditioner_types.mod ps_implicit_types.mod particle_types.mod qs_mo_types.mod cp_para_types.mod pw_env_types.mod admm_types.mod input_section_types.mod scf_control_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_poisson_types.mod particle_list_types.mod hirshfeld_types.mod qs_scf_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod virial_types.mod qs_energy_types.mod qs_rho_types.mod qs_rho_atom_types.mod qs_subsys_types.mod et_coupling_types.mod molecule_types.mod qs_rho0_types.mod minbas_wfn_analysis.mod qs_moments.mod qs_chargemol.mod cp_fm_diag.mod s_square_methods.mod stm_images.mod mao_wfn_analysis.mod qs_mo_methods.mod input_constants.mod qs_mo_occupation.mod cp_ddapc_util.mod qs_electric_field_gradient.mod qs_energy_window.mod atom_kind_orbitals.mod ai_onecenter.mod voronoi_interface.mod memory_utilities.mod qs_active_space_methods.mod cp_dbcsr_operations.mod qs_dos.mod qs_resp.mod cp_fm_struct.mod lapack.mod cp_dbcsr_output.mod mulliken.mod molden_utils.mod cp_blacs_env.mod population_analyses.mod dct.mod mathconstants.mod hirshfeld_methods.mod qs_elf_methods.mod qs_ot_eigensolver.mod qs_loc_dipole.mod admm_utils.mod qs_loc_states.mod pw_methods.mod xray_diffraction.mod qs_epr_hyp.mod qs_pdos.mod qs_grid_atom.mod qs_scf_wfn_mix.mod qs_ks_methods.mod qs_integral_utils.mod qs_local_properties.mod orbital_pointers.mod qs_wannier90.mod message_passing.mod qs_scf_csr_write.mod cp_array_utils.mod qs_loc_utils.mod cp_fm_vect.mod pw_poisson_methods.mod cp_realspace_grid_cube.mod qs_mo_io.mod kinds.mod cp_output_handling.mod transport.mod qs_collocate_density.mod base_hooks.mod physcon.mod qs_core_energies.mod cp_log_handling.mod qs_commutators.mod pw_grids.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_post_gpw.F qs_scf_post_gpw.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:24:07 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_post_gpw.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_post_gpw.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_post_gpw.F:673:13: 673 | IF (compute_lumos) THEN | ^ Warning: ‘compute_lumos’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_scf_post_gpw.mod' due to: qs_scf_post_gpw.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_post_gpw.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_types.mod kpoint_types.mod qs_loc_types.mod qs_environment_types.mod basis_set_types.mod cp_control_types.mod preconditioner_types.mod ps_implicit_types.mod particle_types.mod qs_mo_types.mod cp_para_types.mod pw_env_types.mod admm_types.mod input_section_types.mod scf_control_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_poisson_types.mod particle_list_types.mod hirshfeld_types.mod qs_scf_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod virial_types.mod qs_energy_types.mod qs_rho_types.mod qs_rho_atom_types.mod qs_subsys_types.mod et_coupling_types.mod molecule_types.mod qs_rho0_types.mod minbas_wfn_analysis.mod qs_moments.mod qs_chargemol.mod cp_fm_diag.mod s_square_methods.mod stm_images.mod mao_wfn_analysis.mod qs_mo_methods.mod input_constants.mod qs_mo_occupation.mod cp_ddapc_util.mod qs_electric_field_gradient.mod qs_energy_window.mod atom_kind_orbitals.mod ai_onecenter.mod voronoi_interface.mod memory_utilities.mod qs_active_space_methods.mod cp_dbcsr_operations.mod qs_dos.mod qs_resp.mod cp_fm_struct.mod lapack.mod cp_dbcsr_output.mod mulliken.mod molden_utils.mod cp_blacs_env.mod population_analyses.mod dct.mod mathconstants.mod hirshfeld_methods.mod qs_elf_methods.mod qs_ot_eigensolver.mod qs_loc_dipole.mod admm_utils.mod qs_loc_states.mod pw_methods.mod xray_diffraction.mod qs_epr_hyp.mod qs_pdos.mod qs_grid_atom.mod qs_scf_wfn_mix.mod qs_ks_methods.mod qs_integral_utils.mod qs_local_properties.mod orbital_pointers.mod qs_wannier90.mod message_passing.mod qs_scf_csr_write.mod cp_array_utils.mod qs_loc_utils.mod cp_fm_vect.mod pw_poisson_methods.mod cp_realspace_grid_cube.mod qs_mo_io.mod kinds.mod cp_output_handling.mod transport.mod qs_collocate_density.mod base_hooks.mod physcon.mod qs_core_energies.mod cp_log_handling.mod qs_commutators.mod pw_grids.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_scf_post_tb.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_post_tb.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod qs_scf_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod cp_result_types.mod cp_control_types.mod preconditioner_types.mod xtb_types.mod kpoint_types.mod qs_rho_types.mod task_list_types.mod qs_subsys_types.mod particle_types.mod qs_dftb_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_poisson_types.mod particle_list_types.mod qs_dos.mod moments_utils.mod cp_fm_struct.mod cp_array_utils.mod cp_fm_diag.mod pw_env_methods.mod stm_images.mod pw_methods.mod mulliken.mod input_constants.mod qs_mo_methods.mod molden_utils.mod qs_mo_occupation.mod cp_realspace_grid_cube.mod qs_mo_io.mod kinds.mod qs_dftb_utils.mod cp_blacs_env.mod cp_output_handling.mod population_analyses.mod qs_rho_methods.mod qs_collocate_density.mod qs_energy_window.mod base_hooks.mod mathconstants.mod physcon.mod machine.mod qs_pdos.mod qs_elf_methods.mod cp_fm_cholesky.mod task_list_methods.mod qs_ot_eigensolver.mod qs_scf_wfn_mix.mod cp_log_handling.mod memory_utilities.mod cp_dbcsr_operations.mod cp_result_methods.mod qs_scf_csr_write.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_post_tb.F qs_scf_post_tb.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:24:25 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_post_tb.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_post_tb.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_scf_post_tb.mod' due to: qs_scf_post_tb.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_post_tb.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod qs_scf_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod cp_result_types.mod cp_control_types.mod preconditioner_types.mod xtb_types.mod kpoint_types.mod qs_rho_types.mod task_list_types.mod qs_subsys_types.mod particle_types.mod qs_dftb_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_poisson_types.mod particle_list_types.mod qs_dos.mod moments_utils.mod cp_fm_struct.mod cp_array_utils.mod cp_fm_diag.mod pw_env_methods.mod stm_images.mod pw_methods.mod mulliken.mod input_constants.mod qs_mo_methods.mod molden_utils.mod qs_mo_occupation.mod cp_realspace_grid_cube.mod qs_mo_io.mod kinds.mod qs_dftb_utils.mod cp_blacs_env.mod cp_output_handling.mod population_analyses.mod qs_rho_methods.mod qs_collocate_density.mod qs_energy_window.mod base_hooks.mod mathconstants.mod physcon.mod machine.mod qs_pdos.mod qs_elf_methods.mod cp_fm_cholesky.mod task_list_methods.mod qs_ot_eigensolver.mod qs_scf_wfn_mix.mod cp_log_handling.mod memory_utilities.mod cp_dbcsr_operations.mod cp_result_methods.mod qs_scf_csr_write.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rt_propagation_output.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_propagation_output.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod qs_linres_types.mod qs_rho_types.mod qs_subsys_types.mod particle_types.mod rt_propagation_types.mod input_section_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod particle_list_types.mod cp_fm_struct.mod qs_scf_post_gpw.mod rt_propagation_utils.mod pw_methods.mod input_constants.mod cp_realspace_grid_cube.mod qs_mo_io.mod qs_scf_post_tb.mod kinds.mod cp_dbcsr_operations.mod cp_output_handling.mod base_hooks.mod machine.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_log_handling.mod kahan_sum.mod qs_linres_current.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_propagation_output.F rt_propagation_output.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:24:36 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"emd/rt_propagation_output.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/emd/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_propagation_output.F90 /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_propagation_output.F:726:18: 726 | stride = section_get_ivals(dft_section, "REAL_TIME_PROPAGATION%PRINT%CURRENT%STRIDE") | 1 Warning: POINTER-valued function appears on right-hand side of assignment at (1) [-Wsurprising] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rt_propagation_output.mod' due to: rt_propagation_output.o /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_propagation_output.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod qs_linres_types.mod qs_rho_types.mod qs_subsys_types.mod particle_types.mod rt_propagation_types.mod input_section_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod particle_list_types.mod cp_fm_struct.mod qs_scf_post_gpw.mod rt_propagation_utils.mod pw_methods.mod input_constants.mod cp_realspace_grid_cube.mod qs_mo_io.mod qs_scf_post_tb.mod kinds.mod cp_dbcsr_operations.mod cp_output_handling.mod base_hooks.mod machine.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_log_handling.mod kahan_sum.mod qs_linres_current.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rt_propagation_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_propagation_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod cp_control_types.mod qs_energy_types.mod rt_propagation_types.mod cp_cfm_types.mod qs_environment_types.mod mathlib.mod cp_fm_struct.mod rt_propagation_utils.mod input_constants.mod cp_fm_vect.mod kinds.mod rt_make_propagators.mod bibliography.mod cp_cfm_basic_linalg.mod base_hooks.mod rt_propagation_output.mod cp_fm_basic_linalg.mod ls_matrix_exp.mod cp_log_handling.mod qs_ks_methods.mod qs_energy_init.mod iterate_matrix.mod cp_dbcsr_cholesky.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_propagation_methods.F rt_propagation_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:24:41 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"emd/rt_propagation_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/emd/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_propagation_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rt_propagation_methods.mod' due to: rt_propagation_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_propagation_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod cp_control_types.mod qs_energy_types.mod rt_propagation_types.mod cp_cfm_types.mod qs_environment_types.mod mathlib.mod cp_fm_struct.mod rt_propagation_utils.mod input_constants.mod cp_fm_vect.mod kinds.mod rt_make_propagators.mod bibliography.mod cp_cfm_basic_linalg.mod base_hooks.mod rt_propagation_output.mod cp_fm_basic_linalg.mod ls_matrix_exp.mod cp_log_handling.mod qs_ks_methods.mod qs_energy_init.mod iterate_matrix.mod cp_dbcsr_cholesky.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rt_propagator_init.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_propagator_init.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod cp_control_types.mod rt_propagation_types.mod qs_mo_types.mod qs_environment_types.mod arnoldi_api.mod cp_fm_diag.mod input_constants.mod kinds.mod matrix_exp.mod rt_make_propagators.mod base_hooks.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_log_handling.mod rt_propagation_methods.mod iterate_matrix.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_propagator_init.F rt_propagator_init.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:24:46 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"emd/rt_propagator_init.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/emd/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_propagator_init.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rt_propagator_init.mod' due to: rt_propagator_init.o /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_propagator_init.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod cp_control_types.mod rt_propagation_types.mod qs_mo_types.mod qs_environment_types.mod arnoldi_api.mod cp_fm_diag.mod input_constants.mod kinds.mod matrix_exp.mod rt_make_propagators.mod base_hooks.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_log_handling.mod rt_propagation_methods.mod iterate_matrix.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'helium_types.mod' due to: helium_types.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'neb_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_types.F neb_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:24:49 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/neb_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' neb_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'neb_types.mod' due to: neb_types.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'embed_environment.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/embed_environment.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cp_para_types.mod distribution_1d_types.mod embed_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod base_hooks.mod kinds.mod distribution_methods.mod cp_subsys_methods.mod cell_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/embed_environment.F embed_environment.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:24:51 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"embed_environment.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' embed_environment.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'embed_environment.mod' due to: embed_environment.o /build/cp2k-Q381vr/cp2k-8.1/src/embed_environment.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cp_para_types.mod distribution_1d_types.mod embed_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod base_hooks.mod kinds.mod distribution_methods.mod cp_subsys_methods.mod cell_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'embed_main.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/embed_main.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod embed_types.mod input_section_types.mod cp_para_env.mod base_hooks.mod cp_log_handling.mod kinds.mod embed_environment.mod cp_output_handling.mod message_passing.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/embed_main.F embed_main.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:24:52 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"embed_main.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' embed_main.F90 /build/cp2k-Q381vr/cp2k-8.1/src/embed_main.F:168:68: 168 | embed_env%sub_logger(i)%p%iter_info%project_name = c_val | 1 Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'embed_main.mod' due to: embed_main.o /build/cp2k-Q381vr/cp2k-8.1/src/embed_main.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod embed_types.mod input_section_types.mod cp_para_env.mod base_hooks.mod cp_log_handling.mod kinds.mod embed_environment.mod cp_output_handling.mod message_passing.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_error_handling.mod' due to: cp_error_handling.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'sirius_interface.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/sirius_interface.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pwdft_environment_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod atom_types.mod qs_subsys_types.mod particle_types.mod input_section_types.mod cp_para_types.mod external_potential_types.mod atom_utils.mod input_constants.mod atom_upf.mod kinds.mod cp_output_handling.mod atom_kind_orbitals.mod base_hooks.mod mathconstants.mod qs_grid_atom.mod cp_log_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/sirius_interface.F sirius_interface.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:24:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"sirius_interface.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' sirius_interface.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'sirius_interface.mod' due to: sirius_interface.o /build/cp2k-Q381vr/cp2k-8.1/src/sirius_interface.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pwdft_environment_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod atom_types.mod qs_subsys_types.mod particle_types.mod input_section_types.mod cp_para_types.mod external_potential_types.mod atom_utils.mod input_constants.mod atom_upf.mod kinds.mod cp_output_handling.mod atom_kind_orbitals.mod base_hooks.mod mathconstants.mod qs_grid_atom.mod cp_log_handling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pwdft_environment.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pwdft_environment.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pwdft_environment_types.mod qs_kind_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod virial_types.mod qs_energy_types.mod qs_subsys_types.mod particle_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod distribution_1d_types.mod header.mod particle_methods.mod kinds.mod cp_symmetry.mod base_hooks.mod machine.mod sirius_interface.mod cp_log_handling.mod distribution_methods.mod qs_subsys_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pwdft_environment.F pwdft_environment.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:24:55 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pwdft_environment.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pwdft_environment.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pwdft_environment.mod' due to: pwdft_environment.o /build/cp2k-Q381vr/cp2k-8.1/src/pwdft_environment.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pwdft_environment_types.mod qs_kind_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod virial_types.mod qs_energy_types.mod qs_subsys_types.mod particle_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod distribution_1d_types.mod header.mod particle_methods.mod kinds.mod cp_symmetry.mod base_hooks.mod machine.mod sirius_interface.mod cp_log_handling.mod distribution_methods.mod qs_subsys_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'nnp_model.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/nnp_model.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 nnp_environment_types.mod cp_para_types.mod base_hooks.mod kinds.mod cp_log_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/nnp_model.F nnp_model.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:24:56 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"nnp_model.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' nnp_model.F90 /build/cp2k-Q381vr/cp2k-8.1/src/nnp_model.F:186:94: 186 | arc%layer(i)%node_grad(j) = -1.0_dp*arc%layer(i)%node(j)*arc%layer(i)%node_grad(j) | ^ Warning: ‘j’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'nnp_model.mod' due to: nnp_model.o /build/cp2k-Q381vr/cp2k-8.1/src/nnp_model.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 nnp_environment_types.mod cp_para_types.mod base_hooks.mod kinds.mod cp_log_handling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'nnp_acsf.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/nnp_acsf.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 nnp_environment_types.mod cp_para_types.mod cell_types.mod base_hooks.mod kinds.mod cp_log_handling.mod mathconstants.mod periodic_table.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/nnp_acsf.F nnp_acsf.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:24:58 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"nnp_acsf.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' nnp_acsf.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'nnp_acsf.mod' due to: nnp_acsf.o /build/cp2k-Q381vr/cp2k-8.1/src/nnp_acsf.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 nnp_environment_types.mod cp_para_types.mod cell_types.mod base_hooks.mod kinds.mod cp_log_handling.mod mathconstants.mod periodic_table.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'nnp_environment.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/nnp_environment.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod molecule_kind_types.mod cell_types.mod nnp_environment_types.mod cp_parser_types.mod particle_types.mod molecule_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod distribution_1d_types.mod nnp_model.mod nnp_acsf.mod particle_methods.mod kinds.mod bibliography.mod cp_subsys_methods.mod periodic_table.mod base_hooks.mod cell_methods.mod cp_log_handling.mod distribution_methods.mod cp_parser_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/nnp_environment.F nnp_environment.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:05 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"nnp_environment.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' nnp_environment.F90 /build/cp2k-Q381vr/cp2k-8.1/src/nnp_environment.F:734:68: 734 | WRITE (unit_nr, *) "NNP| NNP force environment initialized" | ^ Warning: ‘unit_nr’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'nnp_environment.mod' due to: nnp_environment.o /build/cp2k-Q381vr/cp2k-8.1/src/nnp_environment.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod molecule_kind_types.mod cell_types.mod nnp_environment_types.mod cp_parser_types.mod particle_types.mod molecule_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod distribution_1d_types.mod nnp_model.mod nnp_acsf.mod particle_methods.mod kinds.mod bibliography.mod cp_subsys_methods.mod periodic_table.mod base_hooks.mod cell_methods.mod cp_log_handling.mod distribution_methods.mod cp_parser_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_nnp.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_nnp.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod kinds.mod bibliography.mod cp_output_handling.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_nnp.F input_cp2k_nnp.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:10 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_nnp.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_nnp.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_nnp.mod' due to: input_cp2k_nnp.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_nnp.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod kinds.mod bibliography.mod cp_output_handling.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_eip.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_eip.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_val_types.mod input_section_types.mod base_hooks.mod input_constants.mod cp_output_handling.mod string_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_eip.F input_cp2k_eip.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:11 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_eip.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_eip.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_eip.mod' due to: input_cp2k_eip.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_eip.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_val_types.mod input_section_types.mod base_hooks.mod input_constants.mod cp_output_handling.mod string_utilities.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_qmmm.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_qmmm.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod input_keyword_types.mod cell_types.mod input_cp2k_subsys.mod base_hooks.mod kinds.mod cp_eri_mme_interface.mod input_cp2k_poisson.mod bibliography.mod cp_units.mod cp_spline_utils.mod cp_output_handling.mod string_utilities.mod input_constants.mod pw_spline_utils.mod input_cp2k_mm.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_qmmm.F input_cp2k_qmmm.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:11 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_qmmm.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_qmmm.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_qmmm.mod' due to: input_cp2k_qmmm.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_qmmm.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod input_keyword_types.mod cell_types.mod input_cp2k_subsys.mod base_hooks.mod kinds.mod cp_eri_mme_interface.mod input_cp2k_poisson.mod bibliography.mod cp_units.mod cp_spline_utils.mod cp_output_handling.mod string_utilities.mod input_constants.mod pw_spline_utils.mod input_cp2k_mm.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_pwdft.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_pwdft.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_val_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_output_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_pwdft.F input_cp2k_pwdft.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:14 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_pwdft.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_pwdft.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_pwdft.mod' due to: input_cp2k_pwdft.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_pwdft.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_val_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_output_handling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_resp.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_resp.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod input_keyword_types.mod base_hooks.mod kinds.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_resp.F input_cp2k_resp.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:14 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_resp.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_resp.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_resp.mod' due to: input_cp2k_resp.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_resp.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod input_keyword_types.mod base_hooks.mod kinds.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_atprop.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_atprop.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod base_hooks.mod bibliography.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_atprop.F input_cp2k_atprop.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:15 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_atprop.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_atprop.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_atprop.mod' due to: input_cp2k_atprop.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_atprop.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod base_hooks.mod bibliography.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_properties_dft.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_properties_dft.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod input_keyword_types.mod base_hooks.mod kinds.mod input_cp2k_dft.mod input_cp2k_loc.mod input_cp2k_xc.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_cp2k_resp.mod input_constants.mod input_cp2k_atprop.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_properties_dft.F input_cp2k_properties_dft.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:15 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_properties_dft.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_properties_dft.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_properties_dft.mod' due to: input_cp2k_properties_dft.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_properties_dft.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod input_keyword_types.mod base_hooks.mod kinds.mod input_cp2k_dft.mod input_cp2k_loc.mod input_cp2k_xc.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_cp2k_resp.mod input_constants.mod input_cp2k_atprop.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_embed.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_embed.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_embed.F input_cp2k_embed.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:18 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_embed.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_embed.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_embed.mod' due to: input_cp2k_embed.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_embed.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_mixed.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_mixed.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod kinds.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_mixed.F input_cp2k_mixed.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:19 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_mixed.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_mixed.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_mixed.mod' due to: input_cp2k_mixed.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_mixed.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod kinds.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_force_eval.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_force_eval.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod input_cp2k_subsys.mod input_cp2k_dft.mod string_utilities.mod input_constants.mod input_cp2k_nnp.mod kinds.mod input_cp2k_eip.mod cp_output_handling.mod base_hooks.mod input_cp2k_qmmm.mod input_cp2k_pwdft.mod input_cp2k_mm.mod cp_units.mod input_cp2k_properties_dft.mod input_cp2k_embed.mod input_cp2k_mixed.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_force_eval.F input_cp2k_force_eval.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:20 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_force_eval.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_force_eval.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_force_eval.mod' due to: input_cp2k_force_eval.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_force_eval.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod input_cp2k_subsys.mod input_cp2k_dft.mod string_utilities.mod input_constants.mod input_cp2k_nnp.mod kinds.mod input_cp2k_eip.mod cp_output_handling.mod base_hooks.mod input_cp2k_qmmm.mod input_cp2k_pwdft.mod input_cp2k_mm.mod cp_units.mod input_cp2k_properties_dft.mod input_cp2k_embed.mod input_cp2k_mixed.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'eip_environment.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/eip_environment.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cp_para_types.mod eip_environment_types.mod distribution_1d_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod base_hooks.mod kinds.mod distribution_methods.mod cp_subsys_methods.mod particle_methods.mod cell_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/eip_environment.F eip_environment.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:21 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eip_environment.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eip_environment.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'eip_environment.mod' due to: eip_environment.o /build/cp2k-Q381vr/cp2k-8.1/src/eip_environment.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cp_para_types.mod eip_environment_types.mod distribution_1d_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod base_hooks.mod kinds.mod distribution_methods.mod cp_subsys_methods.mod particle_methods.mod cell_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mixed_environment.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mixed_environment.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cp_para_types.mod mixed_energy_types.mod mixed_environment_types.mod distribution_1d_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod base_hooks.mod kinds.mod distribution_methods.mod cp_subsys_methods.mod cell_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mixed_environment.F mixed_environment.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:22 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mixed_environment.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mixed_environment.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mixed_environment.mod' due to: mixed_environment.o /build/cp2k-Q381vr/cp2k-8.1/src/mixed_environment.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cp_para_types.mod mixed_energy_types.mod mixed_environment_types.mod distribution_1d_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod base_hooks.mod kinds.mod distribution_methods.mod cp_subsys_methods.mod cell_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mixed_main.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mixed_main.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mixed_environment_types.mod input_section_types.mod cp_para_env.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_output_handling.mod mixed_environment.mod message_passing.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mixed_main.F mixed_main.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:24 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mixed_main.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mixed_main.F90 /build/cp2k-Q381vr/cp2k-8.1/src/mixed_main.F:167:68: 167 | mixed_env%sub_logger(i)%p%iter_info%project_name = c_val | 1 Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mixed_main.mod' due to: mixed_main.o /build/cp2k-Q381vr/cp2k-8.1/src/mixed_main.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mixed_environment_types.mod input_section_types.mod cp_para_env.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_output_handling.mod mixed_environment.mod message_passing.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'force_fields_ext.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/force_fields_ext.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod force_field_kind_types.mod force_field_types.mod particle_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_parser_methods.mod memory_utilities.mod topology_amber.mod cp_output_handling.mod string_utilities.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/force_fields_ext.F force_fields_ext.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_fields_ext.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_fields_ext.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'force_fields_ext.mod' due to: force_fields_ext.o /build/cp2k-Q381vr/cp2k-8.1/src/force_fields_ext.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod force_field_kind_types.mod force_field_types.mod particle_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_parser_methods.mod memory_utilities.mod topology_amber.mod cp_output_handling.mod string_utilities.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'force_fields.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/force_fields.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod molecule_kind_types.mod cell_types.mod fist_nonbond_env_types.mod force_field_kind_types.mod particle_types.mod molecule_types.mod input_section_types.mod ewald_environment_types.mod cp_para_types.mod force_field_types.mod qmmm_types_low.mod input_constants.mod kinds.mod cp_output_handling.mod force_fields_util.mod base_hooks.mod force_fields_input.mod cp_units.mod cp_log_handling.mod force_fields_ext.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/force_fields.F force_fields.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:29 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_fields.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_fields.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'force_fields.mod' due to: force_fields.o /build/cp2k-Q381vr/cp2k-8.1/src/force_fields.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod molecule_kind_types.mod cell_types.mod fist_nonbond_env_types.mod force_field_kind_types.mod particle_types.mod molecule_types.mod input_section_types.mod ewald_environment_types.mod cp_para_types.mod force_field_types.mod qmmm_types_low.mod input_constants.mod kinds.mod cp_output_handling.mod force_fields_util.mod base_hooks.mod force_fields_input.mod cp_units.mod cp_log_handling.mod force_fields_ext.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fist_environment.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fist_environment.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod molecule_kind_types.mod cell_types.mod multipole_types.mod exclusion_types.mod fist_nonbond_env_types.mod fist_environment_types.mod fist_energy_types.mod particle_types.mod molecule_types.mod input_section_types.mod ewald_environment_types.mod fist_efield_types.mod cp_subsys_types.mod cp_para_types.mod qmmm_types_low.mod distribution_1d_types.mod ewald_pw_types.mod particle_list_types.mod header.mod particle_methods.mod kinds.mod bibliography.mod cp_subsys_methods.mod cp_output_handling.mod cp_symmetry.mod base_hooks.mod force_fields.mod cell_methods.mod cp_log_handling.mod ewald_pw_methods.mod distribution_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fist_environment.F fist_environment.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:31 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_environment.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_environment.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fist_environment.mod' due to: fist_environment.o /build/cp2k-Q381vr/cp2k-8.1/src/fist_environment.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod molecule_kind_types.mod cell_types.mod multipole_types.mod exclusion_types.mod fist_nonbond_env_types.mod fist_environment_types.mod fist_energy_types.mod particle_types.mod molecule_types.mod input_section_types.mod ewald_environment_types.mod fist_efield_types.mod cp_subsys_types.mod cp_para_types.mod qmmm_types_low.mod distribution_1d_types.mod ewald_pw_types.mod particle_list_types.mod header.mod particle_methods.mod kinds.mod bibliography.mod cp_subsys_methods.mod cp_output_handling.mod cp_symmetry.mod base_hooks.mod force_fields.mod cell_methods.mod cp_log_handling.mod ewald_pw_methods.mod distribution_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmm_gaussian_data.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gaussian_data.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gaussian_data.F qmmm_gaussian_data.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:33 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_gaussian_data.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_gaussian_data.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmm_gaussian_data.mod' due to: qmmm_gaussian_data.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gaussian_data.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmm_gaussian_input.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gaussian_input.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qmmm_gaussian_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_parser_methods.mod mathconstants.mod physcon.mod string_utilities.mod qmmm_gaussian_data.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gaussian_input.F qmmm_gaussian_input.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:34 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_gaussian_input.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_gaussian_input.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gaussian_input.F:1079:101: 1079 | qmmm_gaussian_fns(IRad)%pgf%Gk(istart + 1:) = qmmm_gaussian_fns(IRad)%pgf%Gk(istart + 1:)*rc | ^ Warning: ‘rc’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gaussian_input.F:654:101: 654 | qmmm_gaussian_fns(IRad)%pgf%Gk(istart + 1:) = qmmm_gaussian_fns(IRad)%pgf%Gk(istart + 1:)*rc | ^ Warning: ‘rc’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmm_gaussian_input.mod' due to: qmmm_gaussian_input.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gaussian_input.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qmmm_gaussian_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_parser_methods.mod mathconstants.mod physcon.mod string_utilities.mod qmmm_gaussian_data.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmm_gaussian_init.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gaussian_init.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qmmm_gaussian_types.mod pw_pool_types.mod pw_env_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod gaussian_gridlevels.mod qmmm_gaussian_input.mod memory_utilities.mod cp_output_handling.mod input_constants.mod ao_util.mod qmmm_gaussian_data.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gaussian_init.F qmmm_gaussian_init.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:37 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_gaussian_init.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_gaussian_init.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmm_gaussian_init.mod' due to: qmmm_gaussian_init.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gaussian_init.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qmmm_gaussian_types.mod pw_pool_types.mod pw_env_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod gaussian_gridlevels.mod qmmm_gaussian_input.mod memory_utilities.mod cp_output_handling.mod input_constants.mod ao_util.mod qmmm_gaussian_data.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmm_elpot.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_elpot.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_gaussian_types.mod qmmm_types_low.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod input_constants.mod kinds.mod mathconstants.mod memory_utilities.mod cp_output_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_elpot.F qmmm_elpot.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:38 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_elpot.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_elpot.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmm_elpot.mod' due to: qmmm_elpot.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_elpot.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_gaussian_types.mod qmmm_types_low.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod input_constants.mod kinds.mod mathconstants.mod memory_utilities.mod cp_output_handling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmm_per_elpot.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_per_elpot.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod qmmm_gaussian_types.mod qmmm_types_low.mod pw_poisson_types.mod ewald_pw_types.mod cell_types.mod ewald_environment_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathconstants.mod cp_output_handling.mod input_constants.mod ewald_spline_util.mod ao_util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_per_elpot.F qmmm_per_elpot.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:40 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_per_elpot.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_per_elpot.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_per_elpot.F:187:54: 187 | LG(idim) = fs*LG(idim)*1.0_dp/Vol | ^ Warning: ‘fs’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmm_per_elpot.mod' due to: qmmm_per_elpot.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_per_elpot.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod qmmm_gaussian_types.mod qmmm_types_low.mod pw_poisson_types.mod ewald_pw_types.mod cell_types.mod ewald_environment_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathconstants.mod cp_output_handling.mod input_constants.mod ewald_spline_util.mod ao_util.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmm_init.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_init.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod molecule_kind_types.mod cell_types.mod shell_potential_types.mod cp_control_types.mod atomic_kind_list_types.mod particle_types.mod pair_potential_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod qs_environment_types.mod force_field_types.mod qmmm_types_low.mod pw_env_types.mod external_potential_types.mod particle_list_types.mod input_constants.mod kinds.mod qmmm_gaussian_init.mod cp_output_handling.mod base_hooks.mod force_fields_input.mod qmmm_ff_fist.mod cp_units.mod cell_methods.mod cp_log_handling.mod cp_eri_mme_interface.mod qmmm_elpot.mod qmmm_per_elpot.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_init.F qmmm_init.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:42 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_init.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_init.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmm_init.mod' due to: qmmm_init.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_init.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod molecule_kind_types.mod cell_types.mod shell_potential_types.mod cp_control_types.mod atomic_kind_list_types.mod particle_types.mod pair_potential_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod qs_environment_types.mod force_field_types.mod qmmm_types_low.mod pw_env_types.mod external_potential_types.mod particle_list_types.mod input_constants.mod kinds.mod qmmm_gaussian_init.mod cp_output_handling.mod base_hooks.mod force_fields_input.mod qmmm_ff_fist.mod cp_units.mod cell_methods.mod cp_log_handling.mod cp_eri_mme_interface.mod qmmm_elpot.mod qmmm_per_elpot.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmm_links_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_links_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types_low.mod particle_types.mod base_hooks.mod cp_log_handling.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_links_methods.F qmmm_links_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:48 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_links_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_links_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmm_links_methods.mod' due to: qmmm_links_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_links_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types_low.mod particle_types.mod base_hooks.mod cp_log_handling.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmm_pw_grid.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_pw_grid.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_pool_types.mod qmmm_types_low.mod pw_env_types.mod base_hooks.mod kinds.mod message_passing.mod input_constants.mod pw_grids.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_pw_grid.F qmmm_pw_grid.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_pw_grid.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_pw_grid.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmm_pw_grid.mod' due to: qmmm_pw_grid.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_pw_grid.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_pool_types.mod qmmm_types_low.mod pw_env_types.mod base_hooks.mod kinds.mod message_passing.mod input_constants.mod pw_grids.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmm_create.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_create.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod cell_types.mod global_types.mod fist_nonbond_env_types.mod fist_environment_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod qs_environment_types.mod qmmm_types_low.mod pw_env_types.mod header.mod input_constants.mod qs_environment.mod kinds.mod bibliography.mod cp_subsys_methods.mod cp_output_handling.mod base_hooks.mod fist_environment.mod cell_methods.mod qmmm_init.mod cp_log_handling.mod qmmm_links_methods.mod qmmm_pw_grid.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_create.F qmmm_create.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:51 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_create.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_create.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmm_create.mod' due to: qmmm_create.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_create.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod cell_types.mod global_types.mod fist_nonbond_env_types.mod fist_environment_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod qs_environment_types.mod qmmm_types_low.mod pw_env_types.mod header.mod input_constants.mod qs_environment.mod kinds.mod bibliography.mod cp_subsys_methods.mod cp_output_handling.mod base_hooks.mod fist_environment.mod cell_methods.mod qmmm_init.mod cp_log_handling.mod qmmm_links_methods.mod qmmm_pw_grid.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmm_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_util.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod force_env_types.mod cp_subsys_types.mod input_section_types.mod qmmm_types.mod qs_environment_types.mod fist_environment_types.mod particle_types.mod qs_kind_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathconstants.mod input_constants.mod particle_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_util.F qmmm_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:55 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_util.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmm_util.mod' due to: qmmm_util.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_util.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod force_env_types.mod cp_subsys_types.mod input_section_types.mod qmmm_types.mod qs_environment_types.mod fist_environment_types.mod particle_types.mod qs_kind_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathconstants.mod input_constants.mod particle_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmmx_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmmx_util.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod atomic_kind_types.mod fist_neighbor_list_types.mod cell_types.mod qmmmx_types.mod particle_types.mod molecule_types.mod input_section_types.mod molecule_list_types.mod cp_subsys_types.mod cp_para_types.mod qmmm_types_low.mod particle_list_types.mod kinds.mod base_hooks.mod fist_neighbor_lists.mod qmmm_ff_fist.mod cp_log_handling.mod qmmm_util.mod memory_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmmx_util.F qmmmx_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:25:58 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmmx_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmmx_util.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmmx_util.mod' due to: qmmmx_util.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmmx_util.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod atomic_kind_types.mod fist_neighbor_list_types.mod cell_types.mod qmmmx_types.mod particle_types.mod molecule_types.mod input_section_types.mod molecule_list_types.mod cp_subsys_types.mod cp_para_types.mod qmmm_types_low.mod particle_list_types.mod kinds.mod base_hooks.mod fist_neighbor_lists.mod qmmm_ff_fist.mod cp_log_handling.mod qmmm_util.mod memory_utilities.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmmx_create.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmmx_create.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod cp_subsys_types.mod cp_para_types.mod qmmmx_types.mod input_section_types.mod global_types.mod base_hooks.mod qmmm_create.mod qmmmx_util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmmx_create.F qmmmx_create.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:26:03 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmmx_create.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmmx_create.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmmx_create.mod' due to: qmmmx_create.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmmx_create.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod cp_subsys_types.mod cp_para_types.mod qmmmx_types.mod input_section_types.mod global_types.mod base_hooks.mod qmmm_create.mod qmmmx_util.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'timings_report.mod' due to: timings_report.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_global.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_global.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod kinds.mod timings.mod cp_dbcsr_cp2k_link.mod cp_blacs_env.mod bibliography.mod machine.mod cp_output_handling.mod cp_fm_elpa.mod string_utilities.mod input_constants.mod grid_api.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_global.F input_cp2k_global.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:26:05 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_global.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_global.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_global.mod' due to: input_cp2k_global.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_global.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod kinds.mod timings.mod cp_dbcsr_cp2k_link.mod cp_blacs_env.mod bibliography.mod machine.mod cp_output_handling.mod cp_fm_elpa.mod string_utilities.mod input_constants.mod grid_api.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'environment.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/environment.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 global_types.mod cp_fm_types.mod force_env_types.mod input_enumeration_types.mod input_section_types.mod cp_para_types.mod input_keyword_types.mod parallel_rng_types.mod timings.mod cp2k_info.mod cp_fm_struct.mod gamma.mod cp_fm_diag.mod header.mod string_utilities.mod input_constants.mod cp_error_handling.mod kinds.mod bibliography.mod cp_output_handling.mod timings_report.mod input_cp2k_global.mod base_hooks.mod fft_tools.mod physcon.mod machine.mod reference_manager.mod voronoi_interface.mod cp_files.mod cp_fm_diag_utils.mod cp_log_handling.mod orbital_transformation_matrices.mod orbital_pointers.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/environment.F environment.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:26:08 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"environment.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' environment.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'environment.mod' due to: environment.o /build/cp2k-Q381vr/cp2k-8.1/src/environment.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 global_types.mod cp_fm_types.mod force_env_types.mod input_enumeration_types.mod input_section_types.mod cp_para_types.mod input_keyword_types.mod parallel_rng_types.mod timings.mod cp2k_info.mod cp_fm_struct.mod gamma.mod cp_fm_diag.mod header.mod string_utilities.mod input_constants.mod cp_error_handling.mod kinds.mod bibliography.mod cp_output_handling.mod timings_report.mod input_cp2k_global.mod base_hooks.mod fft_tools.mod physcon.mod machine.mod reference_manager.mod voronoi_interface.mod cp_files.mod cp_fm_diag_utils.mod cp_log_handling.mod orbital_transformation_matrices.mod orbital_pointers.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_read.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_read.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod input_parsing.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_read.F input_cp2k_read.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:26:11 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_read.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_read.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_read.mod' due to: input_cp2k_read.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_read.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod input_parsing.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'beta_gamma_psi.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/beta_gamma_psi.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/beta_gamma_psi.F beta_gamma_psi.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:26:12 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"beta_gamma_psi.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' beta_gamma_psi.F90 /build/cp2k-Q381vr/cp2k-8.1/src/beta_gamma_psi.F:2275:2: 2275 | 20 f = a*rlog1(-lambda/a) + b*rlog1(lambda/b) | 1 Warning: Label 20 at (1) defined but not used [-Wunused-label] /build/cp2k-Q381vr/cp2k-8.1/src/beta_gamma_psi.F:153:3: 153 | FUNCTION epsln() RESULT(fn_val) | ^ Warning: ‘epsln’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/beta_gamma_psi.F:173:3: 173 | FUNCTION exparg(l) RESULT(fn_val) | ^ Warning: ‘exparg’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/beta_gamma_psi.F:202:3: 202 | FUNCTION depsln() RESULT(fn_val) | ^ Warning: ‘depsln’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/beta_gamma_psi.F:1353:20: 1353 | SUBROUTINE bratio(a, b, x, y, w, w1, ierr) | ^ Warning: ‘bratio’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'beta_gamma_psi.mod' due to: beta_gamma_psi.o /build/cp2k-Q381vr/cp2k-8.1/src/beta_gamma_psi.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fp_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fp_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod particle_types.mod fp_types.mod particle_list_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathconstants.mod cp_output_handling.mod beta_gamma_psi.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fp_methods.F fp_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:26:12 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fp_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fp_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/fp_methods.F:197:72: 197 | tmpstr = cp_iter_string(logger%iter_info, fp_env%print_section) | 1 Warning: CHARACTER expression will be truncated in assignment (15/80) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/fp_methods.F:183:53: 183 | fp_env%bias_weight = EXP(fp_env%bias_energy/kT) | ^ Warning: ‘kt’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fp_methods.mod' due to: fp_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/fp_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod particle_types.mod fp_types.mod particle_list_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathconstants.mod cp_output_handling.mod beta_gamma_psi.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'nnp_force.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/nnp_force.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 nnp_environment_types.mod cp_subsys_types.mod distribution_1d_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod nnp_model.mod physcon.mod cp_output_handling.mod nnp_acsf.mod message_passing.mod periodic_table.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/nnp_force.F nnp_force.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:26:13 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"nnp_force.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' nnp_force.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'nnp_force.mod' due to: nnp_force.o /build/cp2k-Q381vr/cp2k-8.1/src/nnp_force.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 nnp_environment_types.mod cp_subsys_types.mod distribution_1d_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod nnp_model.mod physcon.mod cp_output_handling.mod nnp_acsf.mod message_passing.mod periodic_table.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'constraint_vsite.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/constraint_vsite.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod cp_subsys_types.mod molecule_kind_list_types.mod distribution_1d_types.mod particle_types.mod molecule_types.mod molecule_kind_types.mod particle_list_types.mod molecule_list_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/constraint_vsite.F constraint_vsite.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:26:16 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"constraint_vsite.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' constraint_vsite.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'constraint_vsite.mod' due to: constraint_vsite.o /build/cp2k-Q381vr/cp2k-8.1/src/constraint_vsite.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod cp_subsys_types.mod molecule_kind_list_types.mod distribution_1d_types.mod particle_types.mod molecule_types.mod molecule_kind_types.mod particle_list_types.mod molecule_list_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mixed_cdft_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_cdft_types.mod pw_grid_types.mod mixed_environment_types.mod hirshfeld_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod global_types.mod cp_fm_types.mod force_env_types.mod cp_control_types.mod realspace_grid_types.mod mixed_cdft_types.mod input_section_types.mod cp_subsys_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod cp_fm_struct.mod cp_array_utils.mod pw_env_methods.mod input_constants.mod kinds.mod cp_blacs_env.mod cp_output_handling.mod d3_poly.mod base_hooks.mod cp_files.mod cp_log_handling.mod gaussian_gridlevels.mod cube_utils.mod message_passing.mod cp_realspace_grid_init.mod cp_dbcsr_operations.mod pw_grids.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_utils.F mixed_cdft_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:26:18 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mixed_cdft_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mixed_cdft_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_utils.F:981:69: 981 | mixed_cdft%sub_logger(i)%p%iter_info%project_name = c_val | 1 Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_utils.F:1567:42: 1567 | nzeroed = nzeroed + 1 | ^ Warning: ‘nzeroed’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_utils.F:1058:92: 1058 | TYPE(cp_fm_p_type), DIMENSION(:, :), POINTER :: matrix_p_tmp, mixed_matrix_p_tmp, & | ^ Warning: ‘mixed_matrix_p_tmp.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_utils.F:1058:92: Warning: ‘mixed_matrix_p_tmp.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_utils.F:1056:69: 1056 | TYPE(cp_1d_r_p_type), ALLOCATABLE, DIMENSION(:, :) :: occno_tmp | ^ Warning: ‘occno_tmp.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_utils.F:1056:69: Warning: ‘occno_tmp.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_utils.F:1058:72: 1058 | TYPE(cp_fm_p_type), DIMENSION(:, :), POINTER :: matrix_p_tmp, mixed_matrix_p_tmp, & | ^ Warning: ‘matrix_p_tmp.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_utils.F:1058:72: Warning: ‘matrix_p_tmp.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_utils.F:1064:74: 1064 | TYPE(dbcsr_p_type), DIMENSION(:, :), POINTER :: density_matrix, w_matrix | ^ Warning: ‘density_matrix.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_utils.F:1064:74: Warning: ‘density_matrix.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mixed_cdft_utils.mod' due to: mixed_cdft_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_cdft_types.mod pw_grid_types.mod mixed_environment_types.mod hirshfeld_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod global_types.mod cp_fm_types.mod force_env_types.mod cp_control_types.mod realspace_grid_types.mod mixed_cdft_types.mod input_section_types.mod cp_subsys_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod cp_fm_struct.mod cp_array_utils.mod pw_env_methods.mod input_constants.mod kinds.mod cp_blacs_env.mod cp_output_handling.mod d3_poly.mod base_hooks.mod cp_files.mod cp_log_handling.mod gaussian_gridlevels.mod cube_utils.mod message_passing.mod cp_realspace_grid_init.mod cp_dbcsr_operations.mod pw_grids.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mixed_cdft_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_cdft_types.mod mixed_environment_types.mod hirshfeld_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod force_env_types.mod cp_control_types.mod realspace_grid_types.mod qs_energy_types.mod mixed_cdft_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_subsys_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod particle_list_types.mod mathlib.mod cp_fm_struct.mod cp_array_utils.mod pw_methods.mod qs_mo_methods.mod input_constants.mod cp_realspace_grid_cube.mod qs_mo_io.mod kinds.mod cp_output_handling.mod mixed_cdft_utils.mod cp_dbcsr_diag.mod base_hooks.mod util.mod machine.mod cp_fm_basic_linalg.mod hirshfeld_methods.mod ao_util.mod cp_units.mod cp_gemm_interface.mod cp_log_handling.mod memory_utilities.mod message_passing.mod grid_api.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F mixed_cdft_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:26:36 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mixed_cdft_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mixed_cdft_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:2034:40: 2034 | metric(:, :) = metric(:, :)/4.0_dp | ^ Warning: ‘density_matrix_diff.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:1188:95: 1188 | TYPE(dbcsr_p_type), DIMENSION(:, :), POINTER :: density_matrix, density_matrix_diff, & | ^ note: ‘density_matrix_diff.dim[1].ubound’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:1188:95: Warning: ‘density_matrix_diff.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:1188:95: Warning: ‘density_matrix_diff.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:1171:64: 1171 | INTEGER, ALLOCATABLE, DIMENSION(:, :) :: homo | ^ Warning: ‘homo.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:1171:64: Warning: ‘homo.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:1171:64: Warning: ‘homo.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:1188:74: 1188 | TYPE(dbcsr_p_type), DIMENSION(:, :), POINTER :: density_matrix, density_matrix_diff, & | ^ Warning: ‘density_matrix.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:1509:84: 1509 | density_matrix(jstate, ispin)%matrix, -1.0_dp, 1.0_dp) | ^ Warning: ‘density_matrix.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:1188:74: 1188 | TYPE(dbcsr_p_type), DIMENSION(:, :), POINTER :: density_matrix, density_matrix_diff, & | ^ Warning: ‘density_matrix.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3449:13: 3449 | IF (ANY(mask_send)) THEN | ^ Warning: ‘mask_send.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:2764:80: 2764 | LOGICAL, DIMENSION(:), POINTER :: mask_recv, mask_send, touched | ^ note: ‘mask_send.dim[0].ubound’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3466:13: 3466 | IF (ANY(mask_recv)) THEN | ^ Warning: ‘mask_recv.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:2764:69: 2764 | LOGICAL, DIMENSION(:), POINTER :: mask_recv, mask_send, touched | ^ note: ‘mask_recv.dim[0].ubound’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3401:97: 3401 | ALLOCATE (req_total(COUNT(mixed_cdft%dlb_control%recv_work_repl) + 2*COUNT(touched))) | ^ Warning: ‘touched.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:2764:89: 2764 | LOGICAL, DIMENSION(:), POINTER :: mask_recv, mask_send, touched | ^ note: ‘touched.dim[0].ubound’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:2830:93: 2830 | REAL(bo(2, 1) - bo(1, 1) + 1, dp)) | ^ Warning: ‘my_work_size’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:2309:44: 2309 | jatom, katom, my_work, my_work_size, natom, nforce_eval, nkind, np(3), npme, nthread, & | ^ note: ‘my_work_size’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: 3554 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: cavity, weight | ^ Warning: ‘weight.dim[2].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3877:61: 3877 | DO i = LBOUND(weight, 3), UBOUND(weight, 3) | ^ Warning: ‘weight.dim[2].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: 3554 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: cavity, weight | ^ note: ‘weight.dim[2].lbound’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3877:61: 3877 | DO i = LBOUND(weight, 3), UBOUND(weight, 3) | ^ Warning: ‘weight.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: 3554 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: cavity, weight | ^ note: ‘weight.dim[2].stride’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: Warning: ‘weight.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3829:58: 3829 | DO j = LBOUND(weight, 2), UBOUND(weight, 2) | ^ Warning: ‘weight.dim[1].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: 3554 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: cavity, weight | ^ note: ‘weight.dim[1].lbound’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3829:58: 3829 | DO j = LBOUND(weight, 2), UBOUND(weight, 2) | ^ Warning: ‘weight.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: 3554 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: cavity, weight | ^ note: ‘weight.dim[1].stride’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: Warning: ‘weight.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: Warning: ‘weight.dim[0].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: Warning: ‘weight.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: Warning: ‘weight.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3555:69: 3555 | REAL(KIND=dp), DIMENSION(:, :, :, :), POINTER :: gradients | ^ Warning: ‘gradients.dim[3].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3555:69: Warning: ‘gradients.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3555:69: Warning: ‘gradients.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3555:69: Warning: ‘gradients.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3555:69: Warning: ‘gradients.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3554:66: 3554 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: cavity, weight | ^ Warning: ‘cavity.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3554:66: Warning: ‘cavity.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3554:66: Warning: ‘cavity.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3554:66: Warning: ‘cavity.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3549:68: 3549 | REAL(kind=dp), ALLOCATABLE, DIMENSION(:, :, :) :: dP_i_dRj | ^ Warning: ‘dp_i_drj.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3549:68: Warning: ‘dp_i_drj.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3891:41: 3891 | dP_i_dRi = 0.0_dp | ^ Warning: ‘dp_i_dri.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3548:83: 3548 | distance_vecs, dP_i_dRi | ^ note: ‘dp_i_dri.dim[1].ubound’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3889:44: 3889 | d_sum_Pm_dR = 0.0_dp | ^ Warning: ‘d_sum_pm_dr.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3547:87: 3547 | REAL(kind=dp), ALLOCATABLE, DIMENSION(:, :) :: d_sum_const_dR, d_sum_Pm_dR, & | ^ note: ‘d_sum_pm_dr.dim[1].ubound’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3890:47: 3890 | d_sum_const_dR = 0.0_dp | ^ Warning: ‘d_sum_const_dr.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F:3547:74: 3547 | REAL(kind=dp), ALLOCATABLE, DIMENSION(:, :) :: d_sum_const_dR, d_sum_Pm_dR, & | ^ note: ‘d_sum_const_dr.dim[1].ubound’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mixed_cdft_methods.mod' due to: mixed_cdft_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/mixed_cdft_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_cdft_types.mod mixed_environment_types.mod hirshfeld_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod force_env_types.mod cp_control_types.mod realspace_grid_types.mod qs_energy_types.mod mixed_cdft_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_subsys_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod particle_list_types.mod mathlib.mod cp_fm_struct.mod cp_array_utils.mod pw_methods.mod qs_mo_methods.mod input_constants.mod cp_realspace_grid_cube.mod qs_mo_io.mod kinds.mod cp_output_handling.mod mixed_cdft_utils.mod cp_dbcsr_diag.mod base_hooks.mod util.mod machine.mod cp_fm_basic_linalg.mod hirshfeld_methods.mod ao_util.mod cp_units.mod cp_gemm_interface.mod cp_log_handling.mod memory_utilities.mod message_passing.mod grid_api.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'grrm_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/grrm_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod force_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod base_hooks.mod kinds.mod physcon.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/grrm_utils.F grrm_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:27:17 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"grrm_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' grrm_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'grrm_utils.mod' due to: grrm_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/grrm_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod force_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod base_hooks.mod kinds.mod physcon.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'optimize_dmfet_potential.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/optimize_dmfet_potential.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod cp_control_types.mod embed_types.mod qs_mo_types.mod input_section_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_fm_struct.mod cp_blacs_env.mod cp_dbcsr_operations.mod cp_gemm_interface.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/optimize_dmfet_potential.F optimize_dmfet_potential.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:27:19 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"optimize_dmfet_potential.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' optimize_dmfet_potential.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'optimize_dmfet_potential.mod' due to: optimize_dmfet_potential.o /build/cp2k-Q381vr/cp2k-8.1/src/optimize_dmfet_potential.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod cp_control_types.mod embed_types.mod qs_mo_types.mod input_section_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_fm_struct.mod cp_blacs_env.mod cp_dbcsr_operations.mod cp_gemm_interface.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'restraint.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/restraint.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod cp_subsys_types.mod force_env_types.mod molecule_kind_list_types.mod distribution_1d_types.mod particle_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod particle_list_types.mod molecule_list_types.mod base_hooks.mod constraint_fxd.mod kinds.mod message_passing.mod colvar_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/restraint.F restraint.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:27:21 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"restraint.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' restraint.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'restraint.mod' due to: restraint.o /build/cp2k-Q381vr/cp2k-8.1/src/restraint.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod cp_subsys_types.mod force_env_types.mod molecule_kind_list_types.mod distribution_1d_types.mod particle_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod particle_list_types.mod molecule_list_types.mod base_hooks.mod constraint_fxd.mod kinds.mod message_passing.mod colvar_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mm_collocate_potential.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mm_collocate_potential.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cell_types.mod pw_types.mod base_hooks.mod kinds.mod cube_utils.mod ao_util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mm_collocate_potential.F mm_collocate_potential.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:27:25 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mm_collocate_potential.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mm_collocate_potential.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mm_collocate_potential.mod' due to: mm_collocate_potential.o /build/cp2k-Q381vr/cp2k-8.1/src/mm_collocate_potential.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cell_types.mod pw_types.mod base_hooks.mod kinds.mod cube_utils.mod ao_util.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmm_tb_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_tb_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod cp_control_types.mod xtb_types.mod qs_rho_types.mod qs_ks_qmmm_types.mod particle_types.mod qs_dftb_types.mod input_section_types.mod ewald_environment_types.mod cp_para_types.mod qs_environment_types.mod qmmm_types_low.mod qs_neighbor_list_types.mod pw_poisson_types.mod ewald_pw_types.mod qs_dftb_coulomb.mod mulliken.mod input_constants.mod spme.mod kinds.mod qs_dftb_utils.mod base_hooks.mod qs_overlap.mod qs_dftb_matrices.mod qmmm_util.mod message_passing.mod cp_dbcsr_operations.mod qs_neighbor_lists.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_tb_methods.F qmmm_tb_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:27:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_tb_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_tb_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_tb_methods.F:1395:37: 1395 | force_ab = -fsr*rij/dr | ^ Warning: ‘fsr’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_tb_methods.F:895:13: 895 | IF (do_dftb) THEN | ^ Warning: ‘do_dftb’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_tb_methods.F:897:17: 897 | ELSEIF (do_xtb) THEN | ^ Warning: ‘do_xtb’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_tb_methods.F:652:13: 652 | IF (do_dftb) THEN | ^ Warning: ‘do_dftb’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_tb_methods.F:654:17: 654 | ELSEIF (do_xtb) THEN | ^ Warning: ‘do_xtb’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_tb_methods.F:377:10: 377 | IF (do_dftb) THEN | ^ Warning: ‘do_dftb’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_tb_methods.F:379:14: 379 | ELSEIF (do_xtb) THEN | ^ Warning: ‘do_xtb’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_tb_methods.F:277:10: 277 | IF (do_dftb) THEN | ^ Warning: ‘do_dftb’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_tb_methods.F:279:14: 279 | ELSEIF (do_xtb) THEN | ^ Warning: ‘do_xtb’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_tb_methods.F:161:10: 161 | IF (do_dftb) THEN | ^ Warning: ‘do_dftb’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_tb_methods.F:163:14: 163 | ELSEIF (do_xtb) THEN | ^ Warning: ‘do_xtb’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmm_tb_methods.mod' due to: qmmm_tb_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_tb_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod cp_control_types.mod xtb_types.mod qs_rho_types.mod qs_ks_qmmm_types.mod particle_types.mod qs_dftb_types.mod input_section_types.mod ewald_environment_types.mod cp_para_types.mod qs_environment_types.mod qmmm_types_low.mod qs_neighbor_list_types.mod pw_poisson_types.mod ewald_pw_types.mod qs_dftb_coulomb.mod mulliken.mod input_constants.mod spme.mod kinds.mod qs_dftb_utils.mod base_hooks.mod qs_overlap.mod qs_dftb_matrices.mod qmmm_util.mod message_passing.mod cp_dbcsr_operations.mod qs_neighbor_lists.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmm_se_energy.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_se_energy.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod multipole_types.mod cp_control_types.mod qs_energy_types.mod qs_ks_qmmm_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod qmmm_types_low.mod qs_neighbor_list_types.mod cp_dbcsr_output.mod input_constants.mod kinds.mod semi_empirical_utils.mod cp_output_handling.mod semi_empirical_int_arrays.mod base_hooks.mod qs_overlap.mod cp_log_handling.mod qmmm_util.mod message_passing.mod semi_empirical_integrals.mod cp_dbcsr_operations.mod qs_neighbor_lists.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_se_energy.F qmmm_se_energy.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:27:34 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_se_energy.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_se_energy.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmm_se_energy.mod' due to: qmmm_se_energy.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_se_energy.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod multipole_types.mod cp_control_types.mod qs_energy_types.mod qs_ks_qmmm_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod qmmm_types_low.mod qs_neighbor_list_types.mod cp_dbcsr_output.mod input_constants.mod kinds.mod semi_empirical_utils.mod cp_output_handling.mod semi_empirical_int_arrays.mod base_hooks.mod qs_overlap.mod cp_log_handling.mod qmmm_util.mod message_passing.mod semi_empirical_integrals.mod cp_dbcsr_operations.mod qs_neighbor_lists.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmm_gpw_energy.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gpw_energy.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_gaussian_types.mod cell_types.mod pw_types.mod cp_control_types.mod qs_subsys_types.mod qs_ks_qmmm_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qmmm_types_low.mod pw_env_types.mod particle_list_types.mod mm_collocate_potential.mod cp_spline_utils.mod pw_methods.mod input_constants.mod cp_realspace_grid_cube.mod kinds.mod qmmm_se_energy.mod cp_output_handling.mod base_hooks.mod cp_log_handling.mod qmmm_tb_methods.mod qmmm_util.mod cube_utils.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gpw_energy.F qmmm_gpw_energy.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:27:38 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_gpw_energy.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_gpw_energy.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmm_gpw_energy.mod' due to: qmmm_gpw_energy.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gpw_energy.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_gaussian_types.mod cell_types.mod pw_types.mod cp_control_types.mod qs_subsys_types.mod qs_ks_qmmm_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qmmm_types_low.mod pw_env_types.mod particle_list_types.mod mm_collocate_potential.mod cp_spline_utils.mod pw_methods.mod input_constants.mod cp_realspace_grid_cube.mod kinds.mod qmmm_se_energy.mod cp_output_handling.mod base_hooks.mod cp_log_handling.mod qmmm_tb_methods.mod qmmm_util.mod cube_utils.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmm_se_forces.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_se_forces.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod multipole_types.mod cp_control_types.mod qs_rho_types.mod qs_ks_qmmm_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod qmmm_types_low.mod input_constants.mod kinds.mod semi_empirical_utils.mod semi_empirical_int_arrays.mod base_hooks.mod qmmm_util.mod message_passing.mod semi_empirical_integrals.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_se_forces.F qmmm_se_forces.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:27:41 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_se_forces.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_se_forces.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_se_forces.F:209:17: 209 | CPASSERT(iqm == number_qm_atoms) | ^ Warning: ‘iqm’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmm_se_forces.mod' due to: qmmm_se_forces.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_se_forces.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod multipole_types.mod cp_control_types.mod qs_rho_types.mod qs_ks_qmmm_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod qmmm_types_low.mod input_constants.mod kinds.mod semi_empirical_utils.mod semi_empirical_int_arrays.mod base_hooks.mod qmmm_util.mod message_passing.mod semi_empirical_integrals.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmm_gpw_forces.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gpw_forces.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_gaussian_types.mod cell_types.mod pw_types.mod cp_control_types.mod qs_energy_types.mod qs_rho_types.mod qs_ks_qmmm_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qmmm_types_low.mod pw_env_types.mod mm_collocate_potential.mod cp_spline_utils.mod pw_methods.mod input_constants.mod kinds.mod cp_output_handling.mod base_hooks.mod cp_log_handling.mod qmmm_tb_methods.mod qmmm_util.mod cube_utils.mod qmmm_gpw_energy.mod message_passing.mod qmmm_se_forces.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gpw_forces.F qmmm_gpw_forces.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:27:44 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_gpw_forces.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_gpw_forces.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gpw_forces.F:484:36: 484 | tmp = rho%cr3d(lb(1), :, :) | ^ Warning: ‘tmp.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gpw_forces.F:484:36: Warning: ‘tmp.dim[0].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gpw_forces.F:484:36: Warning: ‘tmp.dim[1].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gpw_forces.F:484:36: 484 | tmp = rho%cr3d(lb(1), :, :) | ^ Warning: ‘tmp.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmm_gpw_forces.mod' due to: qmmm_gpw_forces.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_gpw_forces.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_gaussian_types.mod cell_types.mod pw_types.mod cp_control_types.mod qs_energy_types.mod qs_rho_types.mod qs_ks_qmmm_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qmmm_types_low.mod pw_env_types.mod mm_collocate_potential.mod cp_spline_utils.mod pw_methods.mod input_constants.mod kinds.mod cp_output_handling.mod base_hooks.mod cp_log_handling.mod qmmm_tb_methods.mod qmmm_util.mod cube_utils.mod qmmm_gpw_energy.mod message_passing.mod qmmm_se_forces.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pme.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pme.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod shell_potential_types.mod realspace_grid_types.mod dg_types.mod atprop_types.mod dg_rho0_types.mod particle_types.mod structure_factor_types.mod ewald_environment_types.mod pw_pool_types.mod pw_poisson_types.mod ewald_pw_types.mod pme_tools.mod dgs.mod pw_methods.mod pw_poisson_methods.mod structure_factors.mod kinds.mod bibliography.mod base_hooks.mod mathconstants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pme.F pme.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:27:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pme.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pme.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pme.mod' due to: pme.o /build/cp2k-Q381vr/cp2k-8.1/src/pme.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod shell_potential_types.mod realspace_grid_types.mod dg_types.mod atprop_types.mod dg_rho0_types.mod particle_types.mod structure_factor_types.mod ewald_environment_types.mod pw_pool_types.mod pw_poisson_types.mod ewald_pw_types.mod pme_tools.mod dgs.mod pw_methods.mod pw_poisson_methods.mod structure_factors.mod kinds.mod bibliography.mod base_hooks.mod mathconstants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fist_pol_scf.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fist_pol_scf.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod multipole_types.mod input_section_types.mod pw_poisson_types.mod distribution_1d_types.mod ewald_pw_types.mod particle_types.mod fist_energy_types.mod atomic_kind_types.mod cell_types.mod ewald_environment_types.mod base_hooks.mod cp_log_handling.mod kinds.mod ewalds_multipole.mod cp_output_handling.mod input_constants.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fist_pol_scf.F fist_pol_scf.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:27:53 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_pol_scf.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_pol_scf.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fist_pol_scf.mod' due to: fist_pol_scf.o /build/cp2k-Q381vr/cp2k-8.1/src/fist_pol_scf.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod multipole_types.mod input_section_types.mod pw_poisson_types.mod distribution_1d_types.mod ewald_pw_types.mod particle_types.mod fist_energy_types.mod atomic_kind_types.mod cell_types.mod ewald_environment_types.mod base_hooks.mod cp_log_handling.mod kinds.mod ewalds_multipole.mod cp_output_handling.mod input_constants.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ewalds.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/ewalds.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod atomic_kind_types.mod cell_types.mod shell_potential_types.mod dg_types.mod dg_rho0_types.mod particle_types.mod structure_factor_types.mod ewald_environment_types.mod pw_pool_types.mod pw_poisson_types.mod distribution_1d_types.mod ewald_pw_types.mod mathlib.mod structure_factors.mod kinds.mod bibliography.mod base_hooks.mod mathconstants.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/ewalds.F ewalds.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:27:56 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ewalds.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ewalds.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ewalds.mod' due to: ewalds.o /build/cp2k-Q381vr/cp2k-8.1/src/ewalds.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod atomic_kind_types.mod cell_types.mod shell_potential_types.mod dg_types.mod dg_rho0_types.mod particle_types.mod structure_factor_types.mod ewald_environment_types.mod pw_pool_types.mod pw_poisson_types.mod distribution_1d_types.mod ewald_pw_types.mod mathlib.mod structure_factors.mod kinds.mod bibliography.mod base_hooks.mod mathconstants.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'manybody_tersoff.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/manybody_tersoff.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod fist_neighbor_list_types.mod pair_potential_types.mod cell_types.mod base_hooks.mod kinds.mod mathlib.mod util.mod mathconstants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/manybody_tersoff.F manybody_tersoff.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:27:58 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"manybody_tersoff.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' manybody_tersoff.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'manybody_tersoff.mod' due to: manybody_tersoff.o /build/cp2k-Q381vr/cp2k-8.1/src/manybody_tersoff.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod fist_neighbor_list_types.mod pair_potential_types.mod cell_types.mod base_hooks.mod kinds.mod mathlib.mod util.mod mathconstants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'manybody_gal.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/manybody_gal.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod cp_para_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod fist_neighbor_list_types.mod pair_potential_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod util.mod cp_output_handling.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/manybody_gal.F manybody_gal.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:27:59 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"manybody_gal.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' manybody_gal.F90 /build/cp2k-Q381vr/cp2k-8.1/src/manybody_gal.F:171:126: 171 | - gal%bxy*drji2*sinalpha*sinalpha)) | ^ Warning: ‘sinalpha’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/manybody_gal.F:171:126: Warning: ‘cosalpha’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/manybody_gal.F:172:33: 172 | IF (weight == 0 .AND. index_outfile > 0) WRITE (index_outfile, *) "Fermi 0" | ^ Warning: ‘weight’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'manybody_gal.mod' due to: manybody_gal.o /build/cp2k-Q381vr/cp2k-8.1/src/manybody_gal.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod cp_para_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod fist_neighbor_list_types.mod pair_potential_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod util.mod cp_output_handling.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'manybody_quip.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/manybody_quip.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod cp_para_types.mod particle_types.mod atomic_kind_types.mod pair_potential_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod bibliography.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/manybody_quip.F manybody_quip.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:28:02 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"manybody_quip.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' manybody_quip.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'manybody_quip.mod' due to: manybody_quip.o /build/cp2k-Q381vr/cp2k-8.1/src/manybody_quip.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod cp_para_types.mod particle_types.mod atomic_kind_types.mod pair_potential_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod bibliography.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'manybody_eam.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/manybody_eam.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod cp_para_types.mod particle_types.mod fist_neighbor_list_types.mod pair_potential_types.mod cell_types.mod base_hooks.mod kinds.mod mathlib.mod bibliography.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/manybody_eam.F manybody_eam.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:28:02 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"manybody_eam.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' manybody_eam.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'manybody_eam.mod' due to: manybody_eam.o /build/cp2k-Q381vr/cp2k-8.1/src/manybody_eam.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod cp_para_types.mod particle_types.mod fist_neighbor_list_types.mod pair_potential_types.mod cell_types.mod base_hooks.mod kinds.mod mathlib.mod bibliography.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'manybody_siepmann.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/manybody_siepmann.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod cp_para_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod fist_neighbor_list_types.mod pair_potential_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod util.mod cp_output_handling.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/manybody_siepmann.F manybody_siepmann.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:28:03 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"manybody_siepmann.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' manybody_siepmann.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'manybody_siepmann.mod' due to: manybody_siepmann.o /build/cp2k-Q381vr/cp2k-8.1/src/manybody_siepmann.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod cp_para_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod fist_neighbor_list_types.mod pair_potential_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod util.mod cp_output_handling.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'manybody_potential.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/manybody_potential.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod fist_neighbor_list_types.mod cell_types.mod fist_nonbond_env_types.mod particle_types.mod pair_potential_types.mod input_section_types.mod cp_para_types.mod distribution_1d_types.mod manybody_tersoff.mod mathlib.mod manybody_gal.mod manybody_quip.mod kinds.mod base_hooks.mod util.mod manybody_eam.mod message_passing.mod manybody_siepmann.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/manybody_potential.F manybody_potential.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:28:05 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"manybody_potential.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' manybody_potential.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'manybody_potential.mod' due to: manybody_potential.o /build/cp2k-Q381vr/cp2k-8.1/src/manybody_potential.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod fist_neighbor_list_types.mod cell_types.mod fist_nonbond_env_types.mod particle_types.mod pair_potential_types.mod input_section_types.mod cp_para_types.mod distribution_1d_types.mod manybody_tersoff.mod mathlib.mod manybody_gal.mod manybody_quip.mod kinds.mod base_hooks.mod util.mod manybody_eam.mod message_passing.mod manybody_siepmann.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mol_force.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mol_force.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_field_kind_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mol_force.F mol_force.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:28:11 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mol_force.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mol_force.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mol_force.mod' due to: mol_force.o /build/cp2k-Q381vr/cp2k-8.1/src/mol_force.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_field_kind_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fist_intra_force.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fist_intra_force.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atprop_types.mod distribution_1d_types.mod particle_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mol_force.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fist_intra_force.F fist_intra_force.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:28:14 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_intra_force.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_intra_force.F90 /build/cp2k-Q381vr/cp2k-8.1/src/fist_intra_force.F:119:64: 119 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: pv_a | ^ Warning: ‘pv_a.dim[2].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/fist_intra_force.F:119:64: Warning: ‘pv_a.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/fist_intra_force.F:414:88: 414 | CALL get_pv_torsion(k1, k3, k4, t12, t32, t43, pv_a(:, :, index_d)) | ^ Warning: ‘pv_a.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/fist_intra_force.F:118:66: 118 | REAL(KIND=dp), DIMENSION(:), POINTER :: ener_a | ^ Warning: ‘ener_a.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/fist_intra_force.F:118:66: Warning: ‘ener_a.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/fist_intra_force.F:387:71: 387 | ener_a(index_d) = ener_a(index_d) + energy*0.25_dp | ^ Warning: ‘ener_a.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fist_intra_force.mod' due to: fist_intra_force.o /build/cp2k-Q381vr/cp2k-8.1/src/fist_intra_force.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atprop_types.mod distribution_1d_types.mod particle_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mol_force.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fist_nonbond_force.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fist_nonbond_force.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod fist_neighbor_list_types.mod cell_types.mod fist_nonbond_env_types.mod shell_potential_types.mod splines_types.mod atprop_types.mod particle_types.mod pair_potential_types.mod ewald_environment_types.mod distribution_1d_types.mod mathlib.mod pair_potential_coulomb.mod kinds.mod splines_methods.mod base_hooks.mod mathconstants.mod machine.mod cp_log_handling.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fist_nonbond_force.F fist_nonbond_force.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:28:18 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_nonbond_force.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_nonbond_force.F90 /build/cp2k-Q381vr/cp2k-8.1/src/fist_nonbond_force.F:442:96: 442 | ei_interaction_cutoffs(2, kind_a, kind_b)) | ^ Warning: ‘qcore_b’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/fist_nonbond_force.F:110:60: 110 | fscalar, mm_radius_a, mm_radius_b, qcore_a, qcore_b, qeff_a, qeff_b, qshell_a, qshell_b, & | ^ note: ‘qcore_b’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/fist_nonbond_force.F:399:96: 399 | ei_interaction_cutoffs(1, kind_a, kind_b)) | ^ Warning: ‘qcore_a’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/fist_nonbond_force.F:110:51: 110 | fscalar, mm_radius_a, mm_radius_b, qcore_a, qcore_b, qeff_a, qeff_b, qshell_a, qshell_b, & | ^ note: ‘qcore_a’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/fist_nonbond_force.F:419:96: 419 | ei_interaction_cutoffs(3, kind_a, kind_b)) | ^ Warning: ‘qshell_b’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/fist_nonbond_force.F:110:96: 110 | fscalar, mm_radius_a, mm_radius_b, qcore_a, qcore_b, qeff_a, qeff_b, qshell_a, qshell_b, & | ^ note: ‘qshell_b’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/fist_nonbond_force.F:419:96: 419 | ei_interaction_cutoffs(3, kind_a, kind_b)) | ^ Warning: ‘qshell_a’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/fist_nonbond_force.F:110:86: 110 | fscalar, mm_radius_a, mm_radius_b, qcore_a, qcore_b, qeff_a, qeff_b, qshell_a, qshell_b, & | ^ note: ‘qshell_a’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/fist_nonbond_force.F:478:96: 478 | ei_interaction_cutoffs(3, kind_a, kind_b)) | ^ Warning: ‘qeff_b’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/fist_nonbond_force.F:110:76: 110 | fscalar, mm_radius_a, mm_radius_b, qcore_a, qcore_b, qeff_a, qeff_b, qshell_a, qshell_b, & | ^ note: ‘qeff_b’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/fist_nonbond_force.F:460:96: 460 | ei_interaction_cutoffs(3, kind_a, kind_b)) | ^ Warning: ‘qeff_a’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/fist_nonbond_force.F:110:68: 110 | fscalar, mm_radius_a, mm_radius_b, qcore_a, qcore_b, qeff_a, qeff_b, qshell_a, qshell_b, & | ^ note: ‘qeff_a’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/fist_nonbond_force.F:533:31: 533 | !$OMP ATOMIC | ^ Warning: ‘shell_b’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/fist_nonbond_force.F:104:59: 104 | j, kind_a, kind_b, nkind, npairs, shell_a, shell_b, shell_type | ^ note: ‘shell_b’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/fist_nonbond_force.F:525:31: 525 | !$OMP ATOMIC | ^ Warning: ‘shell_a’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/fist_nonbond_force.F:104:50: 104 | j, kind_a, kind_b, nkind, npairs, shell_a, shell_b, shell_type | ^ note: ‘shell_a’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fist_nonbond_force.mod' due to: fist_nonbond_force.o /build/cp2k-Q381vr/cp2k-8.1/src/fist_nonbond_force.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod fist_neighbor_list_types.mod cell_types.mod fist_nonbond_env_types.mod shell_potential_types.mod splines_types.mod atprop_types.mod particle_types.mod pair_potential_types.mod ewald_environment_types.mod distribution_1d_types.mod mathlib.mod pair_potential_coulomb.mod kinds.mod splines_methods.mod base_hooks.mod mathconstants.mod machine.mod cp_log_handling.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fist_efield_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fist_efield_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_result_types.mod fist_environment_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod cell_types.mod fist_efield_types.mod base_hooks.mod kinds.mod moments_utils.mod mathconstants.mod physcon.mod cp_result_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fist_efield_methods.F fist_efield_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:28:22 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_efield_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_efield_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fist_efield_methods.mod' due to: fist_efield_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/fist_efield_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_result_types.mod fist_environment_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod cell_types.mod fist_efield_types.mod base_hooks.mod kinds.mod moments_utils.mod mathconstants.mod physcon.mod cp_result_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fist_force.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fist_force.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod molecule_kind_types.mod cell_types.mod multipole_types.mod exclusion_types.mod fist_nonbond_env_types.mod shell_potential_types.mod fist_environment_types.mod virial_types.mod fist_energy_types.mod atprop_types.mod particle_types.mod molecule_types.mod ewald_environment_types.mod input_section_types.mod fist_efield_types.mod cp_subsys_types.mod cp_para_types.mod pw_poisson_types.mod distribution_1d_types.mod ewald_pw_types.mod pme.mod input_constants.mod fist_pol_scf.mod spme.mod ewalds.mod kinds.mod manybody_potential.mod fist_neighbor_list_control.mod cp_output_handling.mod fist_intra_force.mod base_hooks.mod fist_nonbond_force.mod ewalds_multipole.mod cp_units.mod manybody_eam.mod cp_log_handling.mod ewald_pw_methods.mod fist_efield_methods.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fist_force.F fist_force.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:28:24 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_force.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_force.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fist_force.mod' due to: fist_force.o /build/cp2k-Q381vr/cp2k-8.1/src/fist_force.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod molecule_kind_types.mod cell_types.mod multipole_types.mod exclusion_types.mod fist_nonbond_env_types.mod shell_potential_types.mod fist_environment_types.mod virial_types.mod fist_energy_types.mod atprop_types.mod particle_types.mod molecule_types.mod ewald_environment_types.mod input_section_types.mod fist_efield_types.mod cp_subsys_types.mod cp_para_types.mod pw_poisson_types.mod distribution_1d_types.mod ewald_pw_types.mod pme.mod input_constants.mod fist_pol_scf.mod spme.mod ewalds.mod kinds.mod manybody_potential.mod fist_neighbor_list_control.mod cp_output_handling.mod fist_intra_force.mod base_hooks.mod fist_nonbond_force.mod ewalds_multipole.mod cp_units.mod manybody_eam.mod cp_log_handling.mod ewald_pw_methods.mod fist_efield_methods.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rt_propagation_forces.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/rt_propagation_forces.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_ks_types.mod atomic_kind_types.mod cp_fm_types.mod qs_force_types.mod cp_control_types.mod particle_types.mod rt_propagation_types.mod qs_mo_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod cp_fm_vect.mod kinds.mod base_hooks.mod mathconstants.mod qs_overlap.mod cp_gemm_interface.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/rt_propagation_forces.F rt_propagation_forces.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:28:31 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rt_propagation_forces.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_propagation_forces.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rt_propagation_forces.mod' due to: rt_propagation_forces.o /build/cp2k-Q381vr/cp2k-8.1/src/rt_propagation_forces.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_ks_types.mod atomic_kind_types.mod cp_fm_types.mod qs_force_types.mod cp_control_types.mod particle_types.mod rt_propagation_types.mod qs_mo_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod cp_fm_vect.mod kinds.mod base_hooks.mod mathconstants.mod qs_overlap.mod cp_gemm_interface.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_kpp1_env_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_kpp1_env_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod qs_p_env_types.mod pw_types.mod qs_kpp1_env_types.mod qs_energy_types.mod qs_rho_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_poisson_types.mod xc_derivative_set_types.mod xc_rho_set_types.mod pw_methods.mod input_constants.mod pw_poisson_methods.mod qs_vxc_atom.mod qs_integrate_potential.mod kinds.mod hartree_local_methods.mod cp_output_handling.mod qs_ks_atom.mod base_hooks.mod xc.mod qs_gapw_densities.mod cp_log_handling.mod qs_ks_methods.mod kahan_sum.mod qs_rho0_ggrid.mod xc_derivatives.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_kpp1_env_methods.F qs_kpp1_env_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:28:35 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_kpp1_env_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_kpp1_env_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_kpp1_env_methods.mod' due to: qs_kpp1_env_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_kpp1_env_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod qs_p_env_types.mod pw_types.mod qs_kpp1_env_types.mod qs_energy_types.mod qs_rho_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_poisson_types.mod xc_derivative_set_types.mod xc_rho_set_types.mod pw_methods.mod input_constants.mod pw_poisson_methods.mod qs_vxc_atom.mod qs_integrate_potential.mod kinds.mod hartree_local_methods.mod cp_output_handling.mod qs_ks_atom.mod base_hooks.mod xc.mod qs_gapw_densities.mod cp_log_handling.mod qs_ks_methods.mod kahan_sum.mod qs_rho0_ggrid.mod xc_derivatives.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_p_env_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_p_env_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_local_rho_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod qs_p_env_types.mod cp_fm_types.mod cp_control_types.mod preconditioner_types.mod qs_kpp1_env_types.mod qs_energy_types.mod qs_linres_types.mod cp_fm_pool_types.mod qs_rho_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_env_types.mod hartree_local_types.mod cp_fm_struct.mod qs_kpp1_env_methods.mod qs_matrix_pools.mod string_utilities.mod input_constants.mod cp_fm_vect.mod kinds.mod cp_blacs_env.mod hartree_local_methods.mod cp_output_handling.mod qs_rho_methods.mod base_hooks.mod qs_rho_atom_methods.mod cp_fm_basic_linalg.mod cp_fm_cholesky.mod cp_gemm_interface.mod cp_log_handling.mod qs_ks_methods.mod qs_rho0_ggrid.mod qs_rho0_methods.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_p_env_methods.F qs_p_env_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:28:42 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_p_env_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_p_env_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_p_env_methods.mod' due to: qs_p_env_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_p_env_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_local_rho_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod qs_p_env_types.mod cp_fm_types.mod cp_control_types.mod preconditioner_types.mod qs_kpp1_env_types.mod qs_energy_types.mod qs_linres_types.mod cp_fm_pool_types.mod qs_rho_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_env_types.mod hartree_local_types.mod cp_fm_struct.mod qs_kpp1_env_methods.mod qs_matrix_pools.mod string_utilities.mod input_constants.mod cp_fm_vect.mod kinds.mod cp_blacs_env.mod hartree_local_methods.mod cp_output_handling.mod qs_rho_methods.mod base_hooks.mod qs_rho_atom_methods.mod cp_fm_basic_linalg.mod cp_fm_cholesky.mod cp_gemm_interface.mod cp_log_handling.mod qs_ks_methods.mod qs_rho0_ggrid.mod qs_rho0_methods.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'response_solver.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/response_solver.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod hfx_types.mod pw_grid_types.mod admm_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod qs_p_env_types.mod pw_types.mod cp_fm_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod qs_linres_types.mod qs_rho_types.mod kg_environment_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_poisson_types.mod xc_derivative_set_types.mod xc_rho_set_types.mod hfx_derivatives.mod qs_kinetic.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod pw_methods.mod qs_linres_methods.mod input_constants.mod pw_poisson_methods.mod hfx_energy_potential.mod qs_integrate_potential.mod kinds.mod cp_blacs_env.mod qs_collocate_density.mod base_hooks.mod kg_correction.mod qs_p_env_methods.mod qs_overlap.mod kg_tnadd_mat.mod xc.mod core_ppl.mod cp_gemm_interface.mod qs_core_energies.mod qs_vxc.mod core_ppnl.mod cp_log_handling.mod qs_ks_methods.mod message_passing.mod xc_derivatives.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/response_solver.F response_solver.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:28:47 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"response_solver.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' response_solver.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'response_solver.mod' due to: response_solver.o /build/cp2k-Q381vr/cp2k-8.1/src/response_solver.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod hfx_types.mod pw_grid_types.mod admm_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod qs_p_env_types.mod pw_types.mod cp_fm_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod qs_linres_types.mod qs_rho_types.mod kg_environment_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_poisson_types.mod xc_derivative_set_types.mod xc_rho_set_types.mod hfx_derivatives.mod qs_kinetic.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod pw_methods.mod qs_linres_methods.mod input_constants.mod pw_poisson_methods.mod hfx_energy_potential.mod qs_integrate_potential.mod kinds.mod cp_blacs_env.mod qs_collocate_density.mod base_hooks.mod kg_correction.mod qs_p_env_methods.mod qs_overlap.mod kg_tnadd_mat.mod xc.mod core_ppl.mod cp_gemm_interface.mod qs_core_energies.mod qs_vxc.mod core_ppnl.mod cp_log_handling.mod qs_ks_methods.mod message_passing.mod xc_derivatives.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ec_efield_local.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/ec_efield_local.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod qs_force_types.mod cp_control_types.mod qs_energy_types.mod ec_env_types.mod qs_period_efield_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_moments.mod kinds.mod ai_moments.mod base_hooks.mod orbital_pointers.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/ec_efield_local.F ec_efield_local.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:29:00 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ec_efield_local.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ec_efield_local.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ec_efield_local.mod' due to: ec_efield_local.o /build/cp2k-Q381vr/cp2k-8.1/src/ec_efield_local.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod qs_force_types.mod cp_control_types.mod qs_energy_types.mod ec_env_types.mod qs_period_efield_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_moments.mod kinds.mod ai_moments.mod base_hooks.mod orbital_pointers.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'energy_corrections.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/energy_corrections.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod basis_set_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod distribution_2d_types.mod qs_energy_types.mod ec_env_types.mod qs_rho_types.mod task_list_types.mod particle_types.mod qs_mo_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod distribution_1d_types.mod external_potential_types.mod pw_poisson_types.mod xc_derivative_set_types.mod xc_rho_set_types.mod moments_utils.mod qs_kinetic.mod qs_dispersion_pairpot.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod qs_moments.mod cp_fm_diag.mod pw_methods.mod input_constants.mod pw_poisson_methods.mod qs_integrate_potential.mod kinds.mod cp_blacs_env.mod cp_output_handling.mod dm_ls_scf_methods.mod qs_collocate_density.mod base_hooks.mod response_solver.mod mao_basis.mod physcon.mod qs_overlap.mod xc.mod cp_fm_basic_linalg.mod core_ppl.mod cp_fm_cholesky.mod task_list_methods.mod ec_efield_local.mod qs_core_energies.mod core_ppnl.mod cp_log_handling.mod qs_ks_methods.mod qs_vxc.mod iterate_matrix.mod message_passing.mod xc_derivatives.mod cp_dbcsr_operations.mod qs_neighbor_lists.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/energy_corrections.F energy_corrections.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:29:04 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"energy_corrections.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' energy_corrections.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'energy_corrections.mod' due to: energy_corrections.o /build/cp2k-Q381vr/cp2k-8.1/src/energy_corrections.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod basis_set_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod distribution_2d_types.mod qs_energy_types.mod ec_env_types.mod qs_rho_types.mod task_list_types.mod particle_types.mod qs_mo_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod distribution_1d_types.mod external_potential_types.mod pw_poisson_types.mod xc_derivative_set_types.mod xc_rho_set_types.mod moments_utils.mod qs_kinetic.mod qs_dispersion_pairpot.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod qs_moments.mod cp_fm_diag.mod pw_methods.mod input_constants.mod pw_poisson_methods.mod qs_integrate_potential.mod kinds.mod cp_blacs_env.mod cp_output_handling.mod dm_ls_scf_methods.mod qs_collocate_density.mod base_hooks.mod response_solver.mod mao_basis.mod physcon.mod qs_overlap.mod xc.mod cp_fm_basic_linalg.mod core_ppl.mod cp_fm_cholesky.mod task_list_methods.mod ec_efield_local.mod qs_core_energies.mod core_ppnl.mod cp_log_handling.mod qs_ks_methods.mod qs_vxc.mod iterate_matrix.mod message_passing.mod xc_derivatives.mod cp_dbcsr_operations.mod qs_neighbor_lists.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'dm_ls_chebyshev.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_chebyshev.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod arnoldi_api.mod dm_ls_scf_qs.mod mathconstants.mod machine.mod cp_output_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_chebyshev.F dm_ls_chebyshev.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:29:16 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dm_ls_chebyshev.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dm_ls_chebyshev.F90 /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_chebyshev.F:370:100: 370 | gdensity(igrid, iwindow) = kernel_g(1)*aitchev_T(1, iwindow) + 2.0_dp*dummy2(iwindow) | ^ Warning: ‘aitchev_t.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_chebyshev.F:370:100: Warning: ‘aitchev_t.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_chebyshev.F:355:72: 355 | chev_Es_dos(igrid) = (chev_E(igrid) - interval_b)/interval_a | ^ Warning: ‘interval_b’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_chebyshev.F:355:72: Warning: ‘interval_a’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'dm_ls_chebyshev.mod' due to: dm_ls_chebyshev.o /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_chebyshev.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod arnoldi_api.mod dm_ls_scf_qs.mod mathconstants.mod machine.mod cp_output_handling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'dm_ls_scf_curvy.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_curvy.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod mathconstants.mod bibliography.mod machine.mod iterate_matrix.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_curvy.F dm_ls_scf_curvy.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:29:20 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dm_ls_scf_curvy.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dm_ls_scf_curvy.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'dm_ls_scf_curvy.mod' due to: dm_ls_scf_curvy.o /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf_curvy.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod mathconstants.mod bibliography.mod machine.mod iterate_matrix.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'dm_ls_scf.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod qs_diis_types.mod qs_ks_types.mod cp_control_types.mod transport_env_types.mod molecule_types.mod input_section_types.mod qs_environment_types.mod mathlib.mod pao_main.mod arnoldi_api.mod qs_diis.mod qs_scf_post_gpw.mod dm_ls_chebyshev.mod pexsi_methods.mod input_constants.mod qs_scf_post_tb.mod cp_external_control.mod kinds.mod bibliography.mod transport.mod dm_ls_scf_methods.mod base_hooks.mod machine.mod dm_ls_scf_curvy.mod cp_log_handling.mod dm_ls_scf_qs.mod iterate_matrix.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf.F dm_ls_scf.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:29:22 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dm_ls_scf.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dm_ls_scf.F90 /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf.F:631:63: 631 | extra_scf = maxscf_reached .OR. scf_converged | ^ Warning: ‘scf_converged’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf.F:631:63: Warning: ‘maxscf_reached’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'dm_ls_scf.mod' due to: dm_ls_scf.o /build/cp2k-Q381vr/cp2k-8.1/src/dm_ls_scf.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod qs_diis_types.mod qs_ks_types.mod cp_control_types.mod transport_env_types.mod molecule_types.mod input_section_types.mod qs_environment_types.mod mathlib.mod pao_main.mod arnoldi_api.mod qs_diis.mod qs_scf_post_gpw.mod dm_ls_chebyshev.mod pexsi_methods.mod input_constants.mod qs_scf_post_tb.mod cp_external_control.mod kinds.mod bibliography.mod transport.mod dm_ls_scf_methods.mod base_hooks.mod machine.mod dm_ls_scf_curvy.mod cp_log_handling.mod dm_ls_scf_qs.mod iterate_matrix.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'domain_submatrix_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/domain_submatrix_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 domain_submatrix_types.mod base_hooks.mod kinds.mod cp_log_handling.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/domain_submatrix_methods.F domain_submatrix_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:29:30 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"domain_submatrix_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' domain_submatrix_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/domain_submatrix_methods.F:771:31: 771 | SUBROUTINE trace_submatrices(A, B, trace) | ^ Warning: ‘trace_submatrices’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'domain_submatrix_methods.mod' due to: domain_submatrix_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/domain_submatrix_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 domain_submatrix_types.mod base_hooks.mod kinds.mod cp_log_handling.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'lri_optimize_ri_basis_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/lri_optimize_ri_basis_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod base_hooks.mod kinds.mod mathconstants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/lri_optimize_ri_basis_types.F lri_optimize_ri_basis_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:29:35 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_optimize_ri_basis_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_optimize_ri_basis_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'lri_optimize_ri_basis_types.mod' due to: lri_optimize_ri_basis_types.o /build/cp2k-Q381vr/cp2k-8.1/src/lri_optimize_ri_basis_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod base_hooks.mod kinds.mod mathconstants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'lri_optimize_ri_basis.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/lri_optimize_ri_basis.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 lri_optimize_ri_basis_types.mod lri_environment_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod qs_rho_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod input_constants.mod lri_environment_methods.mod kinds.mod cp_output_handling.mod generic_os_integrals.mod powell.mod base_hooks.mod cp_log_handling.mod lri_environment_init.mod memory_utilities.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/lri_optimize_ri_basis.F lri_optimize_ri_basis.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:29:37 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_optimize_ri_basis.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_optimize_ri_basis.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'lri_optimize_ri_basis.mod' due to: lri_optimize_ri_basis.o /build/cp2k-Q381vr/cp2k-8.1/src/lri_optimize_ri_basis.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 lri_optimize_ri_basis_types.mod lri_environment_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod qs_rho_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod input_constants.mod lri_environment_methods.mod kinds.mod cp_output_handling.mod generic_os_integrals.mod powell.mod base_hooks.mod cp_log_handling.mod lri_environment_init.mod memory_utilities.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'basis_set_output.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/basis_set_output.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_environment_types.mod qs_kind_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp2k_info.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/basis_set_output.F basis_set_output.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:29:42 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"basis_set_output.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' basis_set_output.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'basis_set_output.mod' due to: basis_set_output.o /build/cp2k-Q381vr/cp2k-8.1/src/basis_set_output.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_environment_types.mod qs_kind_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp2k_info.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_scf_post_se.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_post_se.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod cp_result_types.mod cp_control_types.mod qs_rho_types.mod qs_subsys_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod particle_list_types.mod moments_utils.mod cp_dbcsr_output.mod qs_mo_io.mod kinds.mod ai_moments.mod cp_output_handling.mod base_hooks.mod mathconstants.mod physcon.mod cp_log_handling.mod qs_ks_methods.mod orbital_pointers.mod message_passing.mod cp_result_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_post_se.F qs_scf_post_se.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:29:44 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_post_se.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_post_se.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_scf_post_se.mod' due to: qs_scf_post_se.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_post_se.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod cp_result_types.mod cp_control_types.mod qs_rho_types.mod qs_subsys_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod particle_list_types.mod moments_utils.mod cp_dbcsr_output.mod qs_mo_io.mod kinds.mod ai_moments.mod cp_output_handling.mod base_hooks.mod mathconstants.mod physcon.mod cp_log_handling.mod qs_ks_methods.mod orbital_pointers.mod message_passing.mod cp_result_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'localization_tb.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/localization_tb.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod qs_subsys_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod qs_loc_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod particle_list_types.mod cp_array_utils.mod qs_loc_states.mod qs_loc_utils.mod cp_fm_vect.mod kinds.mod base_hooks.mod cp_log_handling.mod qs_loc_dipole.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/localization_tb.F localization_tb.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:29:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"localization_tb.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' localization_tb.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'localization_tb.mod' due to: localization_tb.o /build/cp2k-Q381vr/cp2k-8.1/src/localization_tb.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod qs_subsys_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod qs_loc_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod particle_list_types.mod cp_array_utils.mod qs_loc_states.mod qs_loc_utils.mod cp_fm_vect.mod kinds.mod base_hooks.mod cp_log_handling.mod qs_loc_dipole.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_band_structure.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_band_structure.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod kpoint_types.mod cp_fm_pool_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_matrix_pools.mod kpoint_methods.mod string_utilities.mod kinds.mod qs_gamma2kp.mod cp_blacs_env.mod cp_para_env.mod base_hooks.mod mathconstants.mod physcon.mod machine.mod cp_files.mod cp_log_handling.mod qs_scf_diagonalization.mod message_passing.mod cp_parser_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_band_structure.F qs_band_structure.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:29:52 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_band_structure.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_band_structure.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_band_structure.mod' due to: qs_band_structure.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_band_structure.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod kpoint_types.mod cp_fm_pool_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_matrix_pools.mod kpoint_methods.mod string_utilities.mod kinds.mod qs_gamma2kp.mod cp_blacs_env.mod cp_para_env.mod base_hooks.mod mathconstants.mod physcon.mod machine.mod cp_files.mod cp_log_handling.mod qs_scf_diagonalization.mod message_passing.mod cp_parser_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_scf_post_scf.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_post_scf.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_control_types.mod qs_scf_types.mod input_section_types.mod base_hooks.mod lri_optimize_ri_basis.mod basis_set_output.mod qs_scf_post_gpw.mod qs_scf_post_se.mod localization_tb.mod qs_band_structure.mod qs_scf_post_tb.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_post_scf.F qs_scf_post_scf.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:29:57 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_post_scf.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_post_scf.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_scf_post_scf.mod' due to: qs_scf_post_scf.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_post_scf.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_control_types.mod qs_scf_types.mod input_section_types.mod base_hooks.mod lri_optimize_ri_basis.mod basis_set_output.mod qs_scf_post_gpw.mod qs_scf_post_se.mod localization_tb.mod qs_band_structure.mod qs_scf_post_tb.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'almo_scf_qs.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_qs.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 almo_scf_types.mod qs_scf_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod qs_energy_types.mod qs_rho_types.mod particle_types.mod qs_mo_types.mod molecule_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod input_constants.mod kinds.mod qs_rho_methods.mod base_hooks.mod cp_units.mod cp_log_handling.mod qs_ks_methods.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_qs.F almo_scf_qs.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:30:00 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"almo_scf_qs.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' almo_scf_qs.F90 /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_qs.F:248:47: 248 | ALLOCATE (distr_new_array(nlength)) | ^ Warning: ‘nlength’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_qs.F:1190:22: 1190 | IF (overlap .EQ. 0.0_dp) THEN | ^ Warning: ‘overlap’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_qs.F:1349:120: 1349 | p_new_block(:, :) = 1.0_dp/(1.0_dp + EXP((r1 - r0)/(r0 - distance) + (r1 - r0)/(r1 - distance))) | ^ Warning: ‘distance’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_qs.F:1303:63: 1303 | rcov=contact2_radius) | ^ Warning: ‘contact_atom_2’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_qs.F:1301:63: 1301 | rcov=contact1_radius) | ^ Warning: ‘contact_atom_1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'almo_scf_qs.mod' due to: almo_scf_qs.o /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_qs.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 almo_scf_types.mod qs_scf_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod qs_energy_types.mod qs_rho_types.mod particle_types.mod qs_mo_types.mod molecule_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod input_constants.mod kinds.mod qs_rho_methods.mod base_hooks.mod cp_units.mod cp_log_handling.mod qs_ks_methods.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'almo_scf_diis_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_diis_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 domain_submatrix_types.mod base_hooks.mod kinds.mod cp_log_handling.mod domain_submatrix_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_diis_types.F almo_scf_diis_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:30:07 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"almo_scf_diis_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' almo_scf_diis_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_diis_types.F:516:41: 516 | almo_scf_diis_error_overlap = trace | ^ Warning: ‘trace’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_diis_types.F:516:41: Warning: ‘trace’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_diis_types.F:317:75: 317 | diis_env%m_b(idomain)%mdata(in_point + 1, irow + 1) = trace0 | ^ Warning: ‘trace0’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'almo_scf_diis_types.mod' due to: almo_scf_diis_types.o /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_diis_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 domain_submatrix_types.mod base_hooks.mod kinds.mod cp_log_handling.mod domain_submatrix_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'almo_scf_lbfgs_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_lbfgs_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_log_handling.mod kinds.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_lbfgs_types.F almo_scf_lbfgs_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:30:09 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"almo_scf_lbfgs_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' almo_scf_lbfgs_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'almo_scf_lbfgs_types.mod' due to: almo_scf_lbfgs_types.o /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_lbfgs_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_log_handling.mod kinds.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ct_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/ct_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod base_hooks.mod kinds.mod cp_blacs_env.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/ct_types.F ct_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:30:10 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ct_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ct_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ct_types.mod' due to: ct_types.o /build/cp2k-Q381vr/cp2k-8.1/src/ct_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod base_hooks.mod kinds.mod cp_blacs_env.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ct_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/ct_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 ct_types.mod base_hooks.mod cp_log_handling.mod kinds.mod machine.mod iterate_matrix.mod input_constants.mod cp_dbcsr_cholesky.mod cp_dbcsr_diag.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/ct_methods.F ct_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:30:10 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ct_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ct_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ct_methods.mod' due to: ct_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/ct_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 ct_types.mod base_hooks.mod cp_log_handling.mod kinds.mod machine.mod iterate_matrix.mod input_constants.mod cp_dbcsr_cholesky.mod cp_dbcsr_diag.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'almo_scf_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 almo_scf_types.mod cp_para_types.mod domain_submatrix_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod domain_submatrix_methods.mod util.mod cp_blacs_env.mod bibliography.mod iterate_matrix.mod input_constants.mod cp_dbcsr_cholesky.mod fermi_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_methods.F almo_scf_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:30:14 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"almo_scf_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' almo_scf_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_methods.F:3034:33: 3034 | SUBROUTINE pseudo_matrix_power(A, Apow, power, N, range1, range1_thr, shift) | ^ Warning: ‘pseudo_matrix_power’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_methods.F:2953:93: 2953 | IF (PRESENT(bad_modes_projector_down)) temp3(jj, :) = Ainv(:, jj)*0.0_dp | ^ Warning: ‘temp3.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_methods.F:2816:79: 2816 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :) :: temp1, temp2, temp3, temp4 | ^ Warning: ‘temp3.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_methods.F:2957:21: 2957 | ELSE IF (use_thr_only) THEN | ^ Warning: ‘use_thr_only’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_methods.F:2941:16: 2941 | IF (use_ranges_only) THEN | ^ Warning: ‘use_ranges_only’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_methods.F:2928:13: 2928 | IF (use_both) THEN | ^ Warning: ‘use_both’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'almo_scf_methods.mod' due to: almo_scf_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 almo_scf_types.mod cp_para_types.mod domain_submatrix_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod domain_submatrix_methods.mod util.mod cp_blacs_env.mod bibliography.mod iterate_matrix.mod input_constants.mod cp_dbcsr_cholesky.mod fermi_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'almo_scf_optimizer.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_optimizer.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 almo_scf_types.mod qs_kind_types.mod domain_submatrix_types.mod cell_types.mod qs_energy_types.mod almo_scf_diis_types.mod particle_types.mod almo_scf_lbfgs_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod ct_types.mod domain_submatrix_methods.mod qs_loc_utils.mod input_constants.mod particle_methods.mod cp_external_control.mod kinds.mod ct_methods.mod cp_blacs_env.mod cp_output_handling.mod almo_scf_qs.mod base_hooks.mod qs_localization_methods.mod machine.mod cp_files.mod cp_log_handling.mod almo_scf_methods.mod iterate_matrix.mod message_passing.mod cp_dbcsr_cholesky.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_optimizer.F almo_scf_optimizer.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:30:29 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"almo_scf_optimizer.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' almo_scf_optimizer.F90 /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_optimizer.F:3218:25: 3218 | SUBROUTINE split_v_blk(almo_scf_env) | ^ Warning: ‘split_v_blk’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_optimizer.F:3287:39: 3287 | SUBROUTINE harris_foulkes_correction(almo_scf_env) | ^ Warning: ‘harris_foulkes_correction’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_optimizer.F:4922:41: 4922 | SUBROUTINE opt_k_create_preconditioner(prec, vd_prop, f, x, oo_inv_x_tr, s, grad, & | ^ Warning: ‘opt_k_create_preconditioner’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_optimizer.F:2039:74: 2039 | TYPE(dbcsr_p_type), DIMENSION(:, :), POINTER :: op_sm_set_almo, op_sm_set_qs | ^ Warning: ‘op_sm_set_almo.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_optimizer.F:2044:64: 2044 | TYPE(dbcsr_type), ALLOCATABLE, DIMENSION(:, :, :) :: m_B0 | ^ Warning: ‘m_b0.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_optimizer.F:2044:64: Warning: ‘m_b0.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_optimizer.F:2044:64: Warning: ‘m_b0.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_optimizer.F:1207:78: 1207 | DO idim0 = 1, SIZE(op_sm_set_qs, 2) ! this loop is over miller ind | ^ Warning: ‘op_sm_set_qs.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_optimizer.F:1207:78: Warning: ‘op_sm_set_qs.dim[1].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_optimizer.F:1208:75: 1208 | DO reim = 1, SIZE(op_sm_set_qs, 1) ! this loop is over Re/Im | ^ Warning: ‘op_sm_set_qs.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_optimizer.F:1208:75: Warning: ‘op_sm_set_qs.dim[0].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_optimizer.F:1211:77: 1211 | almo_scf_env%mat_distr_aos, .FALSE.) | ^ Warning: ‘op_sm_set_qs.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_optimizer.F:1798:64: 1798 | step_size = next_step_size_guess*1.05_dp | ^ Warning: ‘next_step_size_guess’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_optimizer.F:1816:55: 1816 | appr_sec_der = (g1 - g0)/step_size | ^ Warning: ‘g0’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_optimizer.F:1829:76: 1829 | appr_sec_der = 2.0*((e1 - e0)/step_size - g0)/step_size | ^ Warning: ‘e0’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'almo_scf_optimizer.mod' due to: almo_scf_optimizer.o /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf_optimizer.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 almo_scf_types.mod qs_kind_types.mod domain_submatrix_types.mod cell_types.mod qs_energy_types.mod almo_scf_diis_types.mod particle_types.mod almo_scf_lbfgs_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod ct_types.mod domain_submatrix_methods.mod qs_loc_utils.mod input_constants.mod particle_methods.mod cp_external_control.mod kinds.mod ct_methods.mod cp_blacs_env.mod cp_output_handling.mod almo_scf_qs.mod base_hooks.mod qs_localization_methods.mod machine.mod cp_files.mod cp_log_handling.mod almo_scf_methods.mod iterate_matrix.mod message_passing.mod cp_dbcsr_cholesky.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'almo_scf.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 almo_scf_types.mod qs_scf_types.mod qs_kind_types.mod atomic_kind_types.mod cp_fm_types.mod cp_control_types.mod qs_rho_types.mod mscfg_types.mod particle_types.mod qs_mo_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod mathlib.mod domain_submatrix_methods.mod input_constants.mod kinds.mod cp_blacs_env.mod bibliography.mod qs_scf_post_scf.mod almo_scf_qs.mod cp_dbcsr_diag.mod almo_scf_optimizer.mod cp_para_env.mod qs_initial_guess.mod base_hooks.mod cp_log_handling.mod almo_scf_methods.mod iterate_matrix.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf.F almo_scf.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:31:01 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"almo_scf.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' almo_scf.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'almo_scf.mod' due to: almo_scf.o /build/cp2k-Q381vr/cp2k-8.1/src/almo_scf.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 almo_scf_types.mod qs_scf_types.mod qs_kind_types.mod atomic_kind_types.mod cp_fm_types.mod cp_control_types.mod qs_rho_types.mod mscfg_types.mod particle_types.mod qs_mo_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod mathlib.mod domain_submatrix_methods.mod input_constants.mod kinds.mod cp_blacs_env.mod bibliography.mod qs_scf_post_scf.mod almo_scf_qs.mod cp_dbcsr_diag.mod almo_scf_optimizer.mod cp_para_env.mod qs_initial_guess.mod base_hooks.mod cp_log_handling.mod almo_scf_methods.mod iterate_matrix.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_ot_scf.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_ot_scf.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ot_types.mod scf_control_types.mod qs_mo_types.mod input_section_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod qs_ot_minimizer.mod cp_array_utils.mod cp_output_handling.mod qs_ot.mod cp_dbcsr_operations.mod qs_mo_occupation.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_ot_scf.F qs_ot_scf.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:31:18 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ot_scf.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ot_scf.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_ot_scf.mod' due to: qs_ot_scf.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_ot_scf.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ot_types.mod scf_control_types.mod qs_mo_types.mod input_section_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod qs_ot_minimizer.mod cp_array_utils.mod cp_output_handling.mod qs_ot.mod cp_dbcsr_operations.mod qs_mo_occupation.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_scf_loop_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_loop_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_ks_types.mod cp_control_types.mod qs_energy_types.mod kpoint_types.mod qs_rho_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod qs_density_mixing_types.mod qs_scf_output.mod qs_mom_methods.mod qs_mo_methods.mod qs_mo_occupation.mod cp_external_control.mod kinds.mod qs_rho_methods.mod base_hooks.mod qs_fb_env_methods.mod cp_log_handling.mod qs_gspace_mixing.mod qs_mixing_utils.mod qs_scf_diagonalization.mod qs_scf_methods.mod qs_ot_scf.mod qs_outer_scf.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_loop_utils.F qs_scf_loop_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:31:21 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_loop_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_loop_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_scf_loop_utils.mod' due to: qs_scf_loop_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf_loop_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_ks_types.mod cp_control_types.mod qs_energy_types.mod kpoint_types.mod qs_rho_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod qs_density_mixing_types.mod qs_scf_output.mod qs_mom_methods.mod qs_mo_methods.mod qs_mo_occupation.mod cp_external_control.mod kinds.mod qs_rho_methods.mod base_hooks.mod qs_fb_env_methods.mod cp_log_handling.mod qs_gspace_mixing.mod qs_mixing_utils.mod qs_scf_diagonalization.mod qs_scf_methods.mod qs_ot_scf.mod qs_outer_scf.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_cdft_scf_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_scf_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod cp_control_types.mod qs_scf_types.mod scf_control_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod input_constants.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_scf_utils.F qs_cdft_scf_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:31:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_cdft_scf_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_cdft_scf_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_cdft_scf_utils.mod' due to: qs_cdft_scf_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_cdft_scf_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod cp_control_types.mod qs_scf_types.mod scf_control_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod input_constants.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_scf.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_cdft_types.mod qs_scf_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cp_fm_types.mod cp_result_types.mod cp_control_types.mod qs_charges_types.mod qs_energy_types.mod kpoint_types.mod qs_rho_types.mod qs_block_davidson_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod qs_density_mixing_types.mod pw_pool_types.mod pw_env_types.mod mathlib.mod preconditioner.mod qs_diis.mod qs_wf_history_methods.mod qs_scf_output.mod qs_mo_methods.mod input_constants.mod qs_mo_occupation.mod qs_integrate_potential.mod qs_mo_io.mod kinds.mod cp_output_handling.mod qs_scf_post_scf.mod qs_rho_methods.mod qs_scf_loop_utils.mod base_hooks.mod machine.mod cp_files.mod kpoint_io.mod qs_ot.mod cp_log_handling.mod qs_ks_methods.mod qs_scf_initialization.mod qs_cdft_scf_utils.mod message_passing.mod qs_ot_scf.mod cp_dbcsr_operations.mod cp_result_methods.mod qs_outer_scf.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf.F qs_scf.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:31:28 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf.F:1588:31: 1588 | alpha = alpha_ls | ^ Warning: ‘alpha_ls’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf.F:282:59: 282 | scf_control%outer_scf%have_scf = outer_scf_loop | ^ Warning: ‘outer_scf_loop’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf.F:281:45: 281 | scf_control%max_scf = max_scf_tmp | ^ Warning: ‘max_scf_tmp’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_scf.mod' due to: qs_scf.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_scf.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_cdft_types.mod qs_scf_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cp_fm_types.mod cp_result_types.mod cp_control_types.mod qs_charges_types.mod qs_energy_types.mod kpoint_types.mod qs_rho_types.mod qs_block_davidson_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod qs_density_mixing_types.mod pw_pool_types.mod pw_env_types.mod mathlib.mod preconditioner.mod qs_diis.mod qs_wf_history_methods.mod qs_scf_output.mod qs_mo_methods.mod input_constants.mod qs_mo_occupation.mod qs_integrate_potential.mod qs_mo_io.mod kinds.mod cp_output_handling.mod qs_scf_post_scf.mod qs_rho_methods.mod qs_scf_loop_utils.mod base_hooks.mod machine.mod cp_files.mod kpoint_io.mod qs_ot.mod cp_log_handling.mod qs_ks_methods.mod qs_scf_initialization.mod qs_cdft_scf_utils.mod message_passing.mod qs_ot_scf.mod cp_dbcsr_operations.mod cp_result_methods.mod qs_outer_scf.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'et_coupling_proj.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/et_coupling_proj.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod kpoint_types.mod qs_subsys_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod particle_list_types.mod cp_fm_struct.mod cp_fm_diag.mod qs_mo_methods.mod qs_mo_occupation.mod cp_realspace_grid_cube.mod kinds.mod cp_blacs_env.mod bibliography.mod cp_output_handling.mod qs_collocate_density.mod base_hooks.mod physcon.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_log_handling.mod orbital_pointers.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/et_coupling_proj.F et_coupling_proj.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:31:37 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"et_coupling_proj.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' et_coupling_proj.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'et_coupling_proj.mod' due to: et_coupling_proj.o /build/cp2k-Q381vr/cp2k-8.1/src/et_coupling_proj.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod kpoint_types.mod qs_subsys_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod particle_list_types.mod cp_fm_struct.mod cp_fm_diag.mod qs_mo_methods.mod qs_mo_occupation.mod cp_realspace_grid_cube.mod kinds.mod cp_blacs_env.mod bibliography.mod cp_output_handling.mod qs_collocate_density.mod base_hooks.mod physcon.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_log_handling.mod orbital_pointers.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xas_tp_scf.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xas_tp_scf.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod xas_env_types.mod cp_control_types.mod preconditioner_types.mod qs_charges_types.mod qs_energy_types.mod qs_rho_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_loc_types.mod qs_environment_types.mod qs_density_mixing_types.mod preconditioner.mod qs_scf.mod cp_array_utils.mod qs_scf_output.mod xas_restart.mod qs_mo_methods.mod input_constants.mod particle_methods.mod qs_mo_occupation.mod cp_external_control.mod kinds.mod cp_blacs_env.mod cp_output_handling.mod qs_rho_methods.mod base_hooks.mod qs_loc_methods.mod machine.mod qs_ot_eigensolver.mod cp_log_handling.mod qs_ks_methods.mod qs_gspace_mixing.mod qs_mixing_utils.mod qs_scf_diagonalization.mod qs_scf_initialization.mod qs_scf_methods.mod message_passing.mod xas_control.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xas_tp_scf.F xas_tp_scf.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:31:44 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_tp_scf.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_tp_scf.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xas_tp_scf.mod' due to: xas_tp_scf.o /build/cp2k-Q381vr/cp2k-8.1/src/xas_tp_scf.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod xas_env_types.mod cp_control_types.mod preconditioner_types.mod qs_charges_types.mod qs_energy_types.mod qs_rho_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_loc_types.mod qs_environment_types.mod qs_density_mixing_types.mod preconditioner.mod qs_scf.mod cp_array_utils.mod qs_scf_output.mod xas_restart.mod qs_mo_methods.mod input_constants.mod particle_methods.mod qs_mo_occupation.mod cp_external_control.mod kinds.mod cp_blacs_env.mod cp_output_handling.mod qs_rho_methods.mod base_hooks.mod qs_loc_methods.mod machine.mod qs_ot_eigensolver.mod cp_log_handling.mod qs_ks_methods.mod qs_gspace_mixing.mod qs_mixing_utils.mod qs_scf_diagonalization.mod qs_scf_initialization.mod qs_scf_methods.mod message_passing.mod xas_control.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xas_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xas_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod xas_env_types.mod cp_control_types.mod cp_fm_pool_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_loc_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_dbcsr_cp2k_link.mod cp_array_utils.mod cp_fm_struct.mod qs_diis.mod qs_matrix_pools.mod qs_scf.mod qs_loc_utils.mod xas_restart.mod qs_mo_methods.mod input_constants.mod particle_methods.mod ai_overlap.mod qs_mo_io.mod cp_external_control.mod kinds.mod cp_output_handling.mod periodic_table.mod base_hooks.mod qs_operators_ao.mod physcon.mod qs_loc_methods.mod ai_contraction.mod qs_pdos.mod cp_gemm_interface.mod cp_log_handling.mod memory_utilities.mod qs_scf_initialization.mod xas_tp_scf.mod orbital_pointers.mod cp_dbcsr_operations.mod xas_control.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xas_methods.F xas_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:31:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xas_methods.mod' due to: xas_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/xas_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod xas_env_types.mod cp_control_types.mod cp_fm_pool_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_loc_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_dbcsr_cp2k_link.mod cp_array_utils.mod cp_fm_struct.mod qs_diis.mod qs_matrix_pools.mod qs_scf.mod qs_loc_utils.mod xas_restart.mod qs_mo_methods.mod input_constants.mod particle_methods.mod ai_overlap.mod qs_mo_io.mod cp_external_control.mod kinds.mod cp_output_handling.mod periodic_table.mod base_hooks.mod qs_operators_ao.mod physcon.mod qs_loc_methods.mod ai_contraction.mod qs_pdos.mod cp_gemm_interface.mod cp_log_handling.mod memory_utilities.mod qs_scf_initialization.mod xas_tp_scf.mod orbital_pointers.mod cp_dbcsr_operations.mod xas_control.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_stda_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_stda_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_environment_types.mod cp_control_types.mod qs_kind_types.mod atomic_kind_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_stda_types.F qs_tddfpt2_stda_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:31:59 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_stda_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_stda_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_stda_types.mod' due to: qs_tddfpt2_stda_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_stda_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_environment_types.mod cp_control_types.mod qs_kind_types.mod atomic_kind_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_subgroups.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_subgroups.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod distribution_2d_types.mod task_list_types.mod particle_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod distribution_1d_types.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod pw_env_methods.mod input_constants.mod kinds.mod cp_blacs_env.mod cp_para_env.mod base_hooks.mod task_list_methods.mod distribution_methods.mod message_passing.mod cp_dbcsr_operations.mod qs_neighbor_lists.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_subgroups.F qs_tddfpt2_subgroups.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:32:01 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_subgroups.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_subgroups.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_subgroups.F:184:71: 184 | TYPE(mgrid_saved_parameters) :: mgrid_saved | ^ Warning: ‘mgrid_saved.relative_cutoff’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_subgroups.F:184:71: Warning: ‘mgrid_saved.progression_factor’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_subgroups.F:491:44: 491 | qs_control%cutoff = mgrid_saved%cutoff | ^ Warning: ‘mgrid_saved.cutoff’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_subgroups.F:184:71: 184 | TYPE(mgrid_saved_parameters) :: mgrid_saved | ^ note: ‘mgrid_saved.cutoff’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_subgroups.F:490:78: 490 | qs_control%skip_load_balance_distributed = mgrid_saved%skip_load_balance | ^ Warning: ‘MEM [(struct mgrid_saved_parameters *)&mgrid_saved + 8B]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_subgroups.F:184:71: 184 | TYPE(mgrid_saved_parameters) :: mgrid_saved | ^ note: ‘MEM [(struct mgrid_saved_parameters *)&mgrid_saved + 8B]’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_subgroups.F:184:71: Warning: ‘MEM [(struct mgrid_saved_parameters *)&mgrid_saved + 4B]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_subgroups.F:184:71: Warning: ‘MEM [(struct mgrid_saved_parameters *)&mgrid_saved]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_subgroups.mod' due to: qs_tddfpt2_subgroups.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_subgroups.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod distribution_2d_types.mod task_list_types.mod particle_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod distribution_1d_types.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod pw_env_methods.mod input_constants.mod kinds.mod cp_blacs_env.mod cp_para_env.mod base_hooks.mod task_list_methods.mod distribution_methods.mod message_passing.mod cp_dbcsr_operations.mod qs_neighbor_lists.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod admm_types.mod pw_types.mod cp_fm_types.mod qs_tddfpt2_stda_types.mod cp_fm_pool_types.mod qs_rho_types.mod input_section_types.mod ewald_environment_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod xc_derivative_set_types.mod ewald_pw_types.mod xc_rho_set_types.mod cp_fm_struct.mod cp_fm_vect.mod kinds.mod cp_blacs_env.mod qs_rho_methods.mod base_hooks.mod qs_tddfpt2_subgroups.mod xc.mod cp_gemm_interface.mod xc_derivatives.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_types.F qs_tddfpt2_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:32:05 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_types.mod' due to: qs_tddfpt2_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod admm_types.mod pw_types.mod cp_fm_types.mod qs_tddfpt2_stda_types.mod cp_fm_pool_types.mod qs_rho_types.mod input_section_types.mod ewald_environment_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod xc_derivative_set_types.mod ewald_pw_types.mod xc_rho_set_types.mod cp_fm_struct.mod cp_fm_vect.mod kinds.mod cp_blacs_env.mod qs_rho_methods.mod base_hooks.mod qs_tddfpt2_subgroups.mod xc.mod cp_gemm_interface.mod xc_derivatives.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_densities.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_densities.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_rho_types.mod qs_ks_types.mod pw_types.mod cp_fm_types.mod base_hooks.mod kinds.mod qs_tddfpt2_subgroups.mod qs_rho_methods.mod qs_collocate_density.mod cp_dbcsr_operations.mod cp_gemm_interface.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_densities.F qs_tddfpt2_densities.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:32:09 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_densities.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_densities.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_densities.mod' due to: qs_tddfpt2_densities.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_densities.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_rho_types.mod qs_ks_types.mod pw_types.mod cp_fm_types.mod base_hooks.mod kinds.mod qs_tddfpt2_subgroups.mod qs_rho_methods.mod qs_collocate_density.mod cp_dbcsr_operations.mod cp_gemm_interface.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_properties.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_properties.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod qs_subsys_types.mod particle_types.mod cp_cfm_types.mod qs_mo_types.mod qs_tddfpt2_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_poisson_types.mod particle_list_types.mod moments_utils.mod cp_fm_struct.mod dbcsr_vector.mod qs_moments.mod cp_fm_diag.mod string_utilities.mod input_constants.mod molden_utils.mod cp_realspace_grid_cube.mod kinds.mod cp_blacs_env.mod bibliography.mod cp_output_handling.mod qs_collocate_density.mod cp_cfm_basic_linalg.mod base_hooks.mod util.mod qs_operators_ao.mod mathconstants.mod physcon.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_log_handling.mod kahan_sum.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_properties.F qs_tddfpt2_properties.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:32:11 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_properties.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_properties.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_properties.F:680:76: 680 | nmo_virt_occ_alpha = INT(nmo_virt(1), int_8)*INT(nmo_occ(1), int_8) | ^ Warning: ‘nmo_virt[0]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_properties.F:680:76: Warning: ‘nmo_occ[0]’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_properties.F:654:72: 654 | weights_recv | ^ Warning: ‘weights_recv.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_properties.mod' due to: qs_tddfpt2_properties.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_properties.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod qs_subsys_types.mod particle_types.mod cp_cfm_types.mod qs_mo_types.mod qs_tddfpt2_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_poisson_types.mod particle_list_types.mod moments_utils.mod cp_fm_struct.mod dbcsr_vector.mod qs_moments.mod cp_fm_diag.mod string_utilities.mod input_constants.mod molden_utils.mod cp_realspace_grid_cube.mod kinds.mod cp_blacs_env.mod bibliography.mod cp_output_handling.mod qs_collocate_density.mod cp_cfm_basic_linalg.mod base_hooks.mod util.mod qs_operators_ao.mod mathconstants.mod physcon.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_log_handling.mod kahan_sum.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_operators.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_operators.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 admm_types.mod pw_types.mod cp_fm_types.mod qs_rho_types.mod qs_tddfpt2_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_poisson_types.mod xc_rho_set_types.mod cp_fm_struct.mod pw_methods.mod pw_poisson_methods.mod kinds.mod base_hooks.mod xc.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod hfx_admm_utils.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_operators.F qs_tddfpt2_operators.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:32:18 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_operators.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_operators.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_operators.mod' due to: qs_tddfpt2_operators.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_operators.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 admm_types.mod pw_types.mod cp_fm_types.mod qs_rho_types.mod qs_tddfpt2_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod pw_poisson_types.mod xc_rho_set_types.mod cp_fm_struct.mod pw_methods.mod pw_poisson_methods.mod kinds.mod base_hooks.mod xc.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod hfx_admm_utils.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_stda_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_stda_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod virial_types.mod qs_tddfpt2_stda_types.mod atprop_types.mod particle_types.mod qs_tddfpt2_types.mod input_section_types.mod ewald_environment_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod ewald_pw_types.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod cp_fm_diag.mod particle_methods.mod kinds.mod base_hooks.mod util.mod mathconstants.mod qs_tddfpt2_subgroups.mod cp_fm_basic_linalg.mod ewald_methods_tb.mod cp_log_handling.mod iterate_matrix.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_stda_utils.F qs_tddfpt2_stda_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:32:25 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_stda_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_stda_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_stda_utils.F:183:39: 183 | cstring = "GAMMA EXCHANGE MATRIX" | 1 Warning: CHARACTER expression will be truncated in assignment (20/21) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_stda_utils.F:343:47: 343 | CALL copy_dbcsr_to_fm(sm_s, fm_s_half) | ^ Warning: ‘sm_s’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_stda_utils.mod' due to: qs_tddfpt2_stda_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_stda_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod virial_types.mod qs_tddfpt2_stda_types.mod atprop_types.mod particle_types.mod qs_tddfpt2_types.mod input_section_types.mod ewald_environment_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod ewald_pw_types.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod cp_fm_diag.mod particle_methods.mod kinds.mod base_hooks.mod util.mod mathconstants.mod qs_tddfpt2_subgroups.mod cp_fm_basic_linalg.mod ewald_methods_tb.mod cp_log_handling.mod iterate_matrix.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_fhxc.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_fhxc.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_types.mod cp_fm_types.mod cp_control_types.mod qs_tddfpt2_stda_types.mod qs_rho_types.mod qs_tddfpt2_types.mod qs_environment_types.mod qs_tddfpt2_densities.mod pw_methods.mod qs_tddfpt2_operators.mod qs_integrate_potential.mod kinds.mod qs_rho_methods.mod base_hooks.mod qs_tddfpt2_subgroups.mod qs_tddfpt2_stda_utils.mod cp_gemm_interface.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_fhxc.F qs_tddfpt2_fhxc.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:32:29 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_fhxc.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_fhxc.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_fhxc.mod' due to: qs_tddfpt2_fhxc.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_fhxc.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_types.mod cp_fm_types.mod cp_control_types.mod qs_tddfpt2_stda_types.mod qs_rho_types.mod qs_tddfpt2_types.mod qs_environment_types.mod qs_tddfpt2_densities.mod pw_methods.mod qs_tddfpt2_operators.mod qs_integrate_potential.mod kinds.mod qs_rho_methods.mod base_hooks.mod qs_tddfpt2_subgroups.mod qs_tddfpt2_stda_utils.mod cp_gemm_interface.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xc_pot_saop.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xc_pot_saop.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod qs_local_rho_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod xc_derivative_types.mod virial_types.mod qs_rho_types.mod qs_rho_atom_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod xc_derivative_set_types.mod xc_rho_set_types.mod qs_oce_types.mod cp_array_utils.mod pw_methods.mod xc_atom.mod input_constants.mod qs_integrate_potential.mod qs_vxc_atom.mod kinds.mod qs_collocate_density.mod xc_xbecke88.mod qs_ks_atom.mod base_hooks.mod util.mod mathconstants.mod qs_rho_atom_methods.mod xc.mod qs_gapw_densities.mod qs_grid_atom.mod qs_harmonics_atom.mod xc_derivatives.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xc_pot_saop.F xc_pot_saop.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:32:32 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc_pot_saop.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_pot_saop.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xc_pot_saop.mod' due to: xc_pot_saop.o /build/cp2k-Q381vr/cp2k-8.1/src/xc_pot_saop.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod qs_local_rho_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod xc_derivative_types.mod virial_types.mod qs_rho_types.mod qs_rho_atom_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod xc_derivative_set_types.mod xc_rho_set_types.mod qs_oce_types.mod cp_array_utils.mod pw_methods.mod xc_atom.mod input_constants.mod qs_integrate_potential.mod qs_vxc_atom.mod kinds.mod qs_collocate_density.mod xc_xbecke88.mod qs_ks_atom.mod base_hooks.mod util.mod mathconstants.mod qs_rho_atom_methods.mod xc.mod qs_gapw_densities.mod qs_grid_atom.mod qs_harmonics_atom.mod xc_derivatives.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod cp_fm_pool_types.mod qs_mo_types.mod qs_tddfpt2_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod cp_fm_struct.mod cp_array_utils.mod qs_scf_post_gpw.mod input_constants.mod xtb_matrices.mod kinds.mod cp_blacs_env.mod base_hooks.mod util.mod xc_pot_saop.mod physcon.mod cp_fm_basic_linalg.mod cp_fm_cholesky.mod cp_gemm_interface.mod cp_log_handling.mod qs_ks_methods.mod qs_scf_methods.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_utils.F qs_tddfpt2_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:32:48 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_utils.mod' due to: qs_tddfpt2_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod cp_fm_pool_types.mod qs_mo_types.mod qs_tddfpt2_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod cp_fm_struct.mod cp_array_utils.mod qs_scf_post_gpw.mod input_constants.mod xtb_matrices.mod kinds.mod cp_blacs_env.mod base_hooks.mod util.mod xc_pot_saop.mod physcon.mod cp_fm_basic_linalg.mod cp_fm_cholesky.mod cp_gemm_interface.mod cp_log_handling.mod qs_ks_methods.mod qs_scf_methods.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_restart.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_restart.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_pool_types.mod qs_tddfpt2_types.mod input_section_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_blacs_env.mod cp_output_handling.mod cp_fm_basic_linalg.mod string_utilities.mod message_passing.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_restart.F qs_tddfpt2_restart.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:32:52 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_restart.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_restart.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_restart.mod' due to: qs_tddfpt2_restart.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_restart.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_pool_types.mod qs_tddfpt2_types.mod input_section_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_blacs_env.mod cp_output_handling.mod cp_fm_basic_linalg.mod string_utilities.mod message_passing.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_eigensolver.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_eigensolver.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod cp_control_types.mod cp_fm_pool_types.mod qs_tddfpt2_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_tddfpt2_fhxc.mod cp_fm_struct.mod cp_fm_diag.mod input_constants.mod qs_tddfpt2_operators.mod kinds.mod cp_blacs_env.mod cp_output_handling.mod base_hooks.mod physcon.mod qs_tddfpt2_subgroups.mod machine.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_log_handling.mod qs_tddfpt2_utils.mod memory_utilities.mod qs_scf_methods.mod qs_tddfpt2_restart.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_eigensolver.F qs_tddfpt2_eigensolver.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:32:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_eigensolver.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_eigensolver.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_eigensolver.F:390:25: 390 | IF (do_hfx .AND. .NOT. is_stda) THEN | ^ Warning: ‘is_stda’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_eigensolver.F:321:93: 321 | LOGICAL :: do_admm, is_rks_triplets, is_stda | ^ note: ‘is_stda’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_eigensolver.mod' due to: qs_tddfpt2_eigensolver.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_eigensolver.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod cp_control_types.mod cp_fm_pool_types.mod qs_tddfpt2_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_tddfpt2_fhxc.mod cp_fm_struct.mod cp_fm_diag.mod input_constants.mod qs_tddfpt2_operators.mod kinds.mod cp_blacs_env.mod cp_output_handling.mod base_hooks.mod physcon.mod qs_tddfpt2_subgroups.mod machine.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_log_handling.mod qs_tddfpt2_utils.mod memory_utilities.mod qs_scf_methods.mod qs_tddfpt2_restart.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_scf_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod qs_tddfpt2_stda_types.mod cp_fm_pool_types.mod qs_mo_types.mod qs_tddfpt2_types.mod input_section_types.mod qs_environment_types.mod qs_tddfpt2_densities.mod header.mod string_utilities.mod input_constants.mod qs_tddfpt2_properties.mod kinds.mod cp_blacs_env.mod bibliography.mod cp_output_handling.mod base_hooks.mod qs_tddfpt2_eigensolver.mod qs_tddfpt2_subgroups.mod machine.mod qs_tddfpt2_stda_utils.mod cp_log_handling.mod qs_tddfpt2_utils.mod qs_scf_methods.mod qs_tddfpt2_restart.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_methods.F qs_tddfpt2_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:32:59 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_methods.F:262:31: 262 | ALLOCATE (evals(nstates)) | ^ Warning: ‘nstates’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_methods.F:393:13: 393 | IF (do_admm) CALL tddfpt_release_kernel_env(kernel_env%admm_kernel) | ^ Warning: ‘do_admm’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_methods.mod' due to: qs_tddfpt2_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt2_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_scf_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod qs_tddfpt2_stda_types.mod cp_fm_pool_types.mod qs_mo_types.mod qs_tddfpt2_types.mod input_section_types.mod qs_environment_types.mod qs_tddfpt2_densities.mod header.mod string_utilities.mod input_constants.mod qs_tddfpt2_properties.mod kinds.mod cp_blacs_env.mod bibliography.mod cp_output_handling.mod base_hooks.mod qs_tddfpt2_eigensolver.mod qs_tddfpt2_subgroups.mod machine.mod qs_tddfpt2_stda_utils.mod cp_log_handling.mod qs_tddfpt2_utils.mod qs_scf_methods.mod qs_tddfpt2_restart.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'et_coupling.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/et_coupling.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod cp_control_types.mod qs_energy_types.mod cp_fm_pool_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod mathlib.mod cp_fm_struct.mod qs_matrix_pools.mod kinds.mod cp_output_handling.mod base_hooks.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_log_handling.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/et_coupling.F et_coupling.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:33:03 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"et_coupling.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' et_coupling.F90 /build/cp2k-Q381vr/cp2k-8.1/src/et_coupling.F:222:23: 222 | W_mat(1, 1) = Wbb | ^ Warning: ‘wbb’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/et_coupling.F:223:23: 223 | W_mat(2, 2) = Waa | ^ Warning: ‘waa’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/et_coupling.F:243:61: 243 | a(1) = (energy%total + strength*Wbb)*Sda - strength*Wda | ^ Warning: ‘strength’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'et_coupling.mod' due to: et_coupling.o /build/cp2k-Q381vr/cp2k-8.1/src/et_coupling.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod cp_control_types.mod qs_energy_types.mod cp_fm_pool_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod mathlib.mod cp_fm_struct.mod qs_matrix_pools.mod kinds.mod cp_output_handling.mod base_hooks.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_log_handling.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_linres_nmr_epr_common_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_nmr_epr_common_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_pool_types.mod cell_types.mod pw_types.mod base_hooks.mod kinds.mod mathconstants.mod pw_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_nmr_epr_common_utils.F qs_linres_nmr_epr_common_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:33:05 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_nmr_epr_common_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_nmr_epr_common_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_linres_nmr_epr_common_utils.mod' due to: qs_linres_nmr_epr_common_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_nmr_epr_common_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_pool_types.mod cell_types.mod pw_types.mod base_hooks.mod kinds.mod mathconstants.mod pw_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_linres_epr_ownutils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_epr_ownutils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_control_types.mod realspace_grid_types.mod qs_linres_types.mod qs_rho_types.mod qs_rho_atom_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod mathlib.mod qs_linres_op.mod pw_methods.mod kinds.mod qs_linres_nmr_epr_common_utils.mod cp_output_handling.mod base_hooks.mod util.mod qs_grid_atom.mod qs_harmonics_atom.mod qs_core_energies.mod cp_log_handling.mod message_passing.mod pw_spline_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_epr_ownutils.F qs_linres_epr_ownutils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:33:06 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_epr_ownutils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_epr_ownutils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_linres_epr_ownutils.mod' due to: qs_linres_epr_ownutils.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_epr_ownutils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_control_types.mod realspace_grid_types.mod qs_linres_types.mod qs_rho_types.mod qs_rho_atom_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod mathlib.mod qs_linres_op.mod pw_methods.mod kinds.mod qs_linres_nmr_epr_common_utils.mod cp_output_handling.mod base_hooks.mod util.mod qs_grid_atom.mod qs_harmonics_atom.mod qs_core_energies.mod cp_log_handling.mod message_passing.mod pw_spline_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_linres_epr_nablavks.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_epr_nablavks.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_local_rho_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_control_types.mod qs_linres_types.mod qs_rho_types.mod qs_rho_atom_types.mod qs_subsys_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_rho0_types.mod qs_neighbor_list_types.mod pw_poisson_types.mod external_potential_types.mod pw_env_types.mod particle_list_types.mod qs_oce_types.mod pw_methods.mod pw_poisson_methods.mod cp_realspace_grid_cube.mod qs_vxc_atom.mod kinds.mod hartree_local_methods.mod cp_output_handling.mod base_hooks.mod util.mod mathconstants.mod qs_rho_atom_methods.mod qs_gapw_densities.mod qs_grid_atom.mod qs_harmonics_atom.mod qs_vxc.mod cp_log_handling.mod qs_ks_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_epr_nablavks.F qs_linres_epr_nablavks.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:33:10 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_epr_nablavks.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_epr_nablavks.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_linres_epr_nablavks.mod' due to: qs_linres_epr_nablavks.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_epr_nablavks.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_local_rho_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_control_types.mod qs_linres_types.mod qs_rho_types.mod qs_rho_atom_types.mod qs_subsys_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_rho0_types.mod qs_neighbor_list_types.mod pw_poisson_types.mod external_potential_types.mod pw_env_types.mod particle_list_types.mod qs_oce_types.mod pw_methods.mod pw_poisson_methods.mod cp_realspace_grid_cube.mod qs_vxc_atom.mod kinds.mod hartree_local_methods.mod cp_output_handling.mod base_hooks.mod util.mod mathconstants.mod qs_rho_atom_methods.mod qs_gapw_densities.mod qs_grid_atom.mod qs_harmonics_atom.mod qs_vxc.mod cp_log_handling.mod qs_ks_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_linres_nmr_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_nmr_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_linres_types.mod qs_environment_types.mod cp_control_types.mod pw_env_types.mod particle_types.mod cp_parser_types.mod atomic_kind_types.mod input_section_types.mod cell_types.mod scf_control_types.mod base_hooks.mod cp_log_handling.mod kinds.mod qs_matrix_pools.mod memory_utilities.mod cp_units.mod cp_output_handling.mod cp_parser_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_nmr_utils.F qs_linres_nmr_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:33:16 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_nmr_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_nmr_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_linres_nmr_utils.mod' due to: qs_linres_nmr_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_nmr_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_linres_types.mod qs_environment_types.mod cp_control_types.mod pw_env_types.mod particle_types.mod cp_parser_types.mod atomic_kind_types.mod input_section_types.mod cell_types.mod scf_control_types.mod base_hooks.mod cp_log_handling.mod kinds.mod qs_matrix_pools.mod memory_utilities.mod cp_units.mod cp_output_handling.mod cp_parser_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_linres_current_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_current_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod qs_p_env_types.mod cell_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod realspace_grid_types.mod qs_linres_types.mod qs_rho_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_loc_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod qs_linres_op.mod cp_dbcsr_cp2k_link.mod cp_array_utils.mod cp_fm_struct.mod qs_matrix_pools.mod pw_methods.mod qs_linres_methods.mod input_constants.mod particle_methods.mod kinds.mod cp_output_handling.mod base_hooks.mod qs_operators_ao.mod qs_loc_methods.mod cp_fm_basic_linalg.mod cp_log_handling.mod memory_utilities.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_current_utils.F qs_linres_current_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:33:18 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_current_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_current_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_current_utils.F:1152:56: 1152 | state_done(idir, istate_next) = .TRUE. | ^ Warning: ‘istate_next’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_linres_current_utils.mod' due to: qs_linres_current_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_current_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod qs_p_env_types.mod cell_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod realspace_grid_types.mod qs_linres_types.mod qs_rho_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_loc_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod qs_linres_op.mod cp_dbcsr_cp2k_link.mod cp_array_utils.mod cp_fm_struct.mod qs_matrix_pools.mod pw_methods.mod qs_linres_methods.mod input_constants.mod particle_methods.mod kinds.mod cp_output_handling.mod base_hooks.mod qs_operators_ao.mod qs_loc_methods.mod cp_fm_basic_linalg.mod cp_log_handling.mod memory_utilities.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_linres_epr_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_epr_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_control_types.mod qs_linres_types.mod qs_rho_types.mod qs_rho_atom_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod qs_matrix_pools.mod kinds.mod cp_output_handling.mod base_hooks.mod mathconstants.mod physcon.mod cp_log_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_epr_utils.F qs_linres_epr_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:33:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_epr_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_epr_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_linres_epr_utils.mod' due to: qs_linres_epr_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_epr_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_control_types.mod qs_linres_types.mod qs_rho_types.mod qs_rho_atom_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod qs_matrix_pools.mod kinds.mod cp_output_handling.mod base_hooks.mod mathconstants.mod physcon.mod cp_log_handling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_linres_nmr_shift.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_nmr_shift.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_control_types.mod realspace_grid_types.mod qs_linres_types.mod qs_rho_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod mathlib.mod qs_linres_op.mod pw_methods.mod kinds.mod qs_linres_nmr_epr_common_utils.mod cp_output_handling.mod base_hooks.mod util.mod mathconstants.mod qs_grid_atom.mod qs_harmonics_atom.mod cp_log_handling.mod message_passing.mod pw_spline_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_nmr_shift.F qs_linres_nmr_shift.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:33:29 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_nmr_shift.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_nmr_shift.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_nmr_shift.F:267:70: 267 | n_nics, na, natom, natom_local, natom_tot, nkind, nnics_local, nr, nra, nspins, num_pe, & | ^ Warning: ‘nnics_local’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_linres_nmr_shift.mod' due to: qs_linres_nmr_shift.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_nmr_shift.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_control_types.mod realspace_grid_types.mod qs_linres_types.mod qs_rho_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod pw_env_types.mod mathlib.mod qs_linres_op.mod pw_methods.mod kinds.mod qs_linres_nmr_epr_common_utils.mod cp_output_handling.mod base_hooks.mod util.mod mathconstants.mod qs_grid_atom.mod qs_harmonics_atom.mod cp_log_handling.mod message_passing.mod pw_spline_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_linres_issc_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_issc_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod qs_p_env_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod qs_linres_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod mathlib.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod qs_matrix_pools.mod qs_spin_orbit.mod qs_linres_methods.mod particle_methods.mod kinds.mod qs_fermi_contact.mod cp_output_handling.mod qs_elec_field.mod base_hooks.mod physcon.mod cp_fm_basic_linalg.mod cp_log_handling.mod memory_utilities.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_issc_utils.F qs_linres_issc_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:33:34 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_issc_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_issc_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_linres_issc_utils.mod' due to: qs_linres_issc_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_issc_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod qs_p_env_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod qs_linres_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod mathlib.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod qs_matrix_pools.mod qs_spin_orbit.mod qs_linres_methods.mod particle_methods.mod kinds.mod qs_fermi_contact.mod cp_output_handling.mod qs_elec_field.mod base_hooks.mod physcon.mod cp_fm_basic_linalg.mod cp_log_handling.mod memory_utilities.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_linres_module.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_module.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_p_env_types.mod force_env_types.mod cp_control_types.mod qs_linres_types.mod qs_rho_types.mod qs_mo_types.mod input_section_types.mod qs_environment_types.mod qs_linres_op.mod qs_linres_epr_ownutils.mod qs_linres_methods.mod qs_mo_methods.mod input_constants.mod qs_linres_epr_nablavks.mod bibliography.mod cp_output_handling.mod qs_rho_methods.mod qs_linres_nmr_utils.mod base_hooks.mod qs_p_env_methods.mod qs_linres_current_utils.mod qs_linres_epr_utils.mod cp_log_handling.mod qs_linres_polar_utils.mod qs_linres_nmr_shift.mod qs_linres_issc_utils.mod qs_linres_current.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_module.F qs_linres_module.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:33:41 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_module.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_module.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_linres_module.mod' due to: qs_linres_module.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_linres_module.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_p_env_types.mod force_env_types.mod cp_control_types.mod qs_linres_types.mod qs_rho_types.mod qs_mo_types.mod input_section_types.mod qs_environment_types.mod qs_linres_op.mod qs_linres_epr_ownutils.mod qs_linres_methods.mod qs_mo_methods.mod input_constants.mod qs_linres_epr_nablavks.mod bibliography.mod cp_output_handling.mod qs_rho_methods.mod qs_linres_nmr_utils.mod base_hooks.mod qs_p_env_methods.mod qs_linres_current_utils.mod qs_linres_epr_utils.mod cp_log_handling.mod qs_linres_polar_utils.mod qs_linres_nmr_shift.mod qs_linres_issc_utils.mod qs_linres_current.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'group_dist_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/group_dist_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod base_hooks.mod util.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/group_dist_types.F group_dist_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:33:46 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"group_dist_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' group_dist_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'group_dist_types.mod' due to: group_dist_types.o /build/cp2k-Q381vr/cp2k-8.1/src/group_dist_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod base_hooks.mod util.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rpa_rse.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/rpa_rse.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod qs_ks_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod qs_energy_types.mod qs_rho_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod cp_fm_diag.mod hfx_energy_potential.mod kinds.mod cp_blacs_env.mod base_hooks.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod qs_vxc.mod message_passing.mod qs_ks_utils.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/rpa_rse.F rpa_rse.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:33:47 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_rse.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_rse.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rpa_rse.mod' due to: rpa_rse.o /build/cp2k-Q381vr/cp2k-8.1/src/rpa_rse.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod qs_ks_types.mod pw_types.mod cp_fm_types.mod cp_control_types.mod qs_energy_types.mod qs_rho_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod cp_fm_diag.mod hfx_energy_potential.mod kinds.mod cp_blacs_env.mod base_hooks.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod qs_vxc.mod message_passing.mod qs_ks_utils.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mp2_eri_gpw.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri_gpw.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod realspace_grid_types.mod task_list_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_poisson_types.mod pw_env_methods.mod pw_methods.mod input_constants.mod pw_poisson_methods.mod qs_integrate_potential.mod kinds.mod qs_collocate_density.mod base_hooks.mod rs_pw_interface.mod ao_util.mod gaussian_gridlevels.mod orbital_pointers.mod message_passing.mod task_list_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri_gpw.F mp2_eri_gpw.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:33:52 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_eri_gpw.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_eri_gpw.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mp2_eri_gpw.mod' due to: mp2_eri_gpw.o /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri_gpw.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod realspace_grid_types.mod task_list_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_poisson_types.mod pw_env_methods.mod pw_methods.mod input_constants.mod pw_poisson_methods.mod qs_integrate_potential.mod kinds.mod qs_collocate_density.mod base_hooks.mod rs_pw_interface.mod ao_util.mod gaussian_gridlevels.mod orbital_pointers.mod message_passing.mod task_list_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mp2_gpw_method.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mp2_gpw_method.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod group_dist_types.mod cp_control_types.mod task_list_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_poisson_types.mod cp_fm_struct.mod qs_integrate_potential.mod kinds.mod cp_blacs_env.mod qs_collocate_density.mod cp_para_env.mod base_hooks.mod machine.mod mp2_eri_gpw.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mp2_gpw_method.F mp2_gpw_method.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:33:55 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_gpw_method.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_gpw_method.F90 /build/cp2k-Q381vr/cp2k-8.1/src/mp2_gpw_method.F:162:65: 162 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :) :: BIb_C, BIb_Ex, BIb_send | ^ Warning: ‘bib_c.dim[2].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_gpw_method.F:162:65: Warning: ‘bib_c.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_gpw_method.F:162:65: Warning: ‘bib_c.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_gpw_method.F:566:65: 566 | - Eigenval(j + EX_start - 1)) | ^ Warning: ‘bib_c.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_gpw_method.F:438:36: 438 | IF (calc_ex) BIb_C = 0.0_dp | ^ Warning: ‘bib_c.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_gpw_method.F:535:127: 535 | /(Eigenval(a) + Eigenval(homo + b_global) - Eigenval(i + my_I_occupied_start - 1) - Eigenval(j)) | ^ Warning: ‘bib_c.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_gpw_method.F:381:68: 381 | sub_sub_color = color_array(para_env_sub%mepos, my_q_position) | ^ Warning: ‘my_q_position’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_gpw_method.F:335:94: 335 | my_I_occupied_end = my_I_occupied_start + vector_batch_I_size_group(i_group_counter) - 1 | ^ Warning: ‘i_group_counter’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mp2_gpw_method.mod' due to: mp2_gpw_method.o /build/cp2k-Q381vr/cp2k-8.1/src/mp2_gpw_method.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod group_dist_types.mod cp_control_types.mod task_list_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_poisson_types.mod cp_fm_struct.mod qs_integrate_potential.mod kinds.mod cp_blacs_env.mod qs_collocate_density.mod cp_para_env.mod base_hooks.mod machine.mod mp2_eri_gpw.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mp2_ri_grad_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_grad_util.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod group_dist_types.mod mp2_types.mod cp_fm_types.mod base_hooks.mod kinds.mod util.mod cp_fm_struct.mod cp_blacs_env.mod message_passing.mod cp_dbcsr_operations.mod cp_gemm_interface.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_grad_util.F mp2_ri_grad_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:34:02 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_ri_grad_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_ri_grad_util.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mp2_ri_grad_util.mod' due to: mp2_ri_grad_util.o /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_grad_util.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod group_dist_types.mod mp2_types.mod cp_fm_types.mod base_hooks.mod kinds.mod util.mod cp_fm_struct.mod cp_blacs_env.mod message_passing.mod cp_dbcsr_operations.mod cp_gemm_interface.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mp2_ri_gpw.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_gpw.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod group_dist_types.mod mp2_types.mod cp_para_env.mod base_hooks.mod kinds.mod mp2_ri_grad_util.mod machine.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_gpw.F mp2_ri_gpw.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:34:09 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_ri_gpw.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_ri_gpw.F90 /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_gpw.F:2582:68: 2582 | para_env_exchange%group) | ^ Warning: ‘send_k’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_gpw.F:2551:65: 2551 | para_env_exchange%group) | ^ Warning: ‘send_j’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_gpw.F:2524:65: 2524 | para_env_exchange%group) | ^ Warning: ‘send_i’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_gpw.F:720:45: 720 | gd_array%sizes(:) = sizes_array_orig | ^ Warning: ‘MEM[(struct array01_integer(kind=4) &)&sizes_array_orig].dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mp2_ri_gpw.mod' due to: mp2_ri_gpw.o /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_gpw.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod group_dist_types.mod mp2_types.mod cp_para_env.mod base_hooks.mod kinds.mod mp2_ri_grad_util.mod machine.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mp2_eri.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod eri_mme_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod ai_coulomb.mod input_constants.mod ai_contraction_sphi.mod kinds.mod base_hooks.mod eri_mme_test.mod util.mod eri_mme_integrate.mod cp_eri_mme_interface.mod qs_integral_utils.mod orbital_pointers.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F mp2_eri.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:34:49 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_eri.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_eri.F90 /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1381:71: 1381 | ncoa, ncob, ncoc, nsgfa, nsgfb, nsgfc) | ^ Warning: ‘habdc_contr.dim[3].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1122:71: 1122 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :, :) :: habdc_contr, habdc_uncontr, hadbc_contr, & | ^ Warning: ‘habdc_contr.dim[3].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1381:71: 1381 | ncoa, ncob, ncoc, nsgfa, nsgfb, nsgfc) | ^ Warning: ‘habdc_contr.dim[2].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1122:71: 1122 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :, :) :: habdc_contr, habdc_uncontr, hadbc_contr, & | ^ Warning: ‘habdc_contr.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1381:71: 1381 | ncoa, ncob, ncoc, nsgfa, nsgfb, nsgfc) | ^ Warning: ‘habdc_contr.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1122:71: 1122 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :, :) :: habdc_contr, habdc_uncontr, hadbc_contr, & | ^ Warning: ‘habdc_contr.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1376:71: 1376 | ncoa, ncob, ncoc, nsgfa, nsgfb, nsgfc) | ^ Warning: ‘hadbc_contr.dim[3].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1122:99: 1122 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :, :) :: habdc_contr, habdc_uncontr, hadbc_contr, & | ^ Warning: ‘hadbc_contr.dim[3].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1376:71: 1376 | ncoa, ncob, ncoc, nsgfa, nsgfb, nsgfc) | ^ Warning: ‘hadbc_contr.dim[2].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1122:99: 1122 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :, :) :: habdc_contr, habdc_uncontr, hadbc_contr, & | ^ Warning: ‘hadbc_contr.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1376:71: 1376 | ncoa, ncob, ncoc, nsgfa, nsgfb, nsgfc) | ^ Warning: ‘hadbc_contr.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1122:99: 1122 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :, :) :: habdc_contr, habdc_uncontr, hadbc_contr, & | ^ Warning: ‘hadbc_contr.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1371:71: 1371 | ncoa, ncob, ncoc, nsgfa, nsgfb, nsgfc) | ^ Warning: ‘hdabc_contr.dim[3].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1123:86: 1123 | hadbc_uncontr, hdabc_contr, & | ^ Warning: ‘hdabc_contr.dim[3].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1371:71: 1371 | ncoa, ncob, ncoc, nsgfa, nsgfb, nsgfc) | ^ Warning: ‘hdabc_contr.dim[2].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1123:86: 1123 | hadbc_uncontr, hdabc_contr, & | ^ Warning: ‘hdabc_contr.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1371:71: 1371 | ncoa, ncob, ncoc, nsgfa, nsgfb, nsgfc) | ^ Warning: ‘hdabc_contr.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1123:86: 1123 | hadbc_uncontr, hdabc_contr, & | ^ Warning: ‘hdabc_contr.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1120:84: 1120 | habc_uncontr_d, pabc_hhh, & | ^ Warning: ‘pabc_hhh.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1120:84: Warning: ‘pabc_hhh.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1120:84: Warning: ‘pabc_hhh.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1176:89: 1176 | CALL eri_mme_set_potential(param, convert_potential_type(potential_type), omega) | ^ Warning: ‘res’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1381:71: 1381 | ncoa, ncob, ncoc, nsgfa, nsgfb, nsgfc) | ^ Warning: ‘habdc_uncontr.dim[3].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1122:86: 1122 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :, :) :: habdc_contr, habdc_uncontr, hadbc_contr, & | ^ Warning: ‘habdc_uncontr.dim[3].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1381:71: 1381 | ncoa, ncob, ncoc, nsgfa, nsgfb, nsgfc) | ^ Warning: ‘habdc_uncontr.dim[2].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1122:86: 1122 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :, :) :: habdc_contr, habdc_uncontr, hadbc_contr, & | ^ Warning: ‘habdc_uncontr.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1381:71: 1381 | ncoa, ncob, ncoc, nsgfa, nsgfb, nsgfc) | ^ Warning: ‘habdc_uncontr.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1287:116: 1287 | habc_uncontr_d(ico, jco, kcoz)] | ^ Warning: ‘habdc_uncontr.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1376:71: 1376 | ncoa, ncob, ncoc, nsgfa, nsgfb, nsgfc) | ^ Warning: ‘hadbc_uncontr.dim[3].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1123:73: 1123 | hadbc_uncontr, hdabc_contr, & | ^ Warning: ‘hadbc_uncontr.dim[3].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1376:71: 1376 | ncoa, ncob, ncoc, nsgfa, nsgfb, nsgfc) | ^ Warning: ‘hadbc_uncontr.dim[2].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1123:73: 1123 | hadbc_uncontr, hdabc_contr, & | ^ Warning: ‘hadbc_uncontr.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1376:71: 1376 | ncoa, ncob, ncoc, nsgfa, nsgfb, nsgfc) | ^ Warning: ‘hadbc_uncontr.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1281:116: 1281 | habc_uncontr_d(ico, jcoz, kco)] | ^ Warning: ‘hadbc_uncontr.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1371:71: 1371 | ncoa, ncob, ncoc, nsgfa, nsgfb, nsgfc) | ^ Warning: ‘hdabc_uncontr.dim[3].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1124:73: 1124 | hdabc_uncontr, v_work | ^ Warning: ‘hdabc_uncontr.dim[3].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1371:71: 1371 | ncoa, ncob, ncoc, nsgfa, nsgfb, nsgfc) | ^ Warning: ‘hdabc_uncontr.dim[2].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1124:73: 1124 | hdabc_uncontr, v_work | ^ Warning: ‘hdabc_uncontr.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1371:71: 1371 | ncoa, ncob, ncoc, nsgfa, nsgfb, nsgfc) | ^ Warning: ‘hdabc_uncontr.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:1275:116: 1275 | habc_uncontr_d(icoz, jco, kco)] | ^ Warning: ‘hdabc_uncontr.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:572:93: 572 | sphi_a(:, sgfa:), sphi_b(:, sgfb:), ncoa, ncob, nsgfa, nsgfb) | ^ Warning: ‘hdab_uncontr.dim[2].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:572:93: Warning: ‘hdab_uncontr.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:572:93: Warning: ‘hdab_uncontr.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:519:93: 519 | hab_uncontr_d(icoz, jco)] | ^ Warning: ‘hdab_uncontr.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:576:93: 576 | sphi_a(:, sgfa:), sphi_b(:, sgfb:), ncoa, ncob, nsgfa, nsgfb) | ^ Warning: ‘hadb_contr.dim[2].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:407:70: 407 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :) :: hadb_contr, hadb_uncontr, hdab_contr, & | ^ Warning: ‘hadb_contr.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:576:93: 576 | sphi_a(:, sgfa:), sphi_b(:, sgfb:), ncoa, ncob, nsgfa, nsgfb) | ^ Warning: ‘hadb_contr.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:407:70: 407 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :) :: hadb_contr, hadb_uncontr, hdab_contr, & | ^ Warning: ‘hadb_contr.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:572:93: 572 | sphi_a(:, sgfa:), sphi_b(:, sgfb:), ncoa, ncob, nsgfa, nsgfb) | ^ Warning: ‘hdab_contr.dim[2].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:407:96: 407 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :) :: hadb_contr, hadb_uncontr, hdab_contr, & | ^ Warning: ‘hdab_contr.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:572:93: 572 | sphi_a(:, sgfa:), sphi_b(:, sgfb:), ncoa, ncob, nsgfa, nsgfb) | ^ Warning: ‘hdab_contr.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:407:96: 407 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :) :: hadb_contr, hadb_uncontr, hdab_contr, & | ^ Warning: ‘hdab_contr.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:405:81: 405 | hab_uncontr_d, pab_hh, pab_hs, & | ^ Warning: ‘pab_hh.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:405:81: Warning: ‘pab_hh.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:456:89: 456 | CALL eri_mme_set_potential(param, convert_potential_type(potential_type), omega) | ^ Warning: ‘res’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:576:93: 576 | sphi_a(:, sgfa:), sphi_b(:, sgfb:), ncoa, ncob, nsgfa, nsgfb) | ^ Warning: ‘hadb_uncontr.dim[2].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:407:84: 407 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :) :: hadb_contr, hadb_uncontr, hdab_contr, & | ^ Warning: ‘hadb_uncontr.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:576:93: 576 | sphi_a(:, sgfa:), sphi_b(:, sgfb:), ncoa, ncob, nsgfa, nsgfb) | ^ Warning: ‘hadb_uncontr.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:525:93: 525 | hab_uncontr_d(ico, jcoz)] | ^ Warning: ‘hadb_uncontr.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F:744:13: 744 | IF (jatom /= last_jatom) THEN | ^ Warning: ‘last_jatom’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mp2_eri.mod' due to: mp2_eri.o /build/cp2k-Q381vr/cp2k-8.1/src/mp2_eri.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod eri_mme_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod ai_coulomb.mod input_constants.mod ai_contraction_sphi.mod kinds.mod base_hooks.mod eri_mme_test.mod util.mod eri_mme_integrate.mod cp_eri_mme_interface.mod qs_integral_utils.mod orbital_pointers.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mp2_ri_grad.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_grad.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod basis_set_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod realspace_grid_types.mod task_list_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_poisson_types.mod cp_fm_struct.mod pw_methods.mod input_constants.mod pw_poisson_methods.mod mp2_eri.mod qs_integrate_potential.mod kinds.mod cp_blacs_env.mod qs_collocate_density.mod cp_para_env.mod rs_pw_interface.mod base_hooks.mod util.mod mathconstants.mod ao_util.mod cp_gemm_interface.mod cp_eri_mme_interface.mod gaussian_gridlevels.mod mp2_eri_gpw.mod orbital_pointers.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_grad.F mp2_ri_grad.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:35:34 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_ri_grad.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_ri_grad.F90 /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_grad.F:190:79: 190 | TYPE(dbcsr_p_type), DIMENSION(:), POINTER :: G_P_ia, G_P_ia_beta, mat_munu_local, & | ^ Warning: ‘g_p_ia_beta.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_grad.F:190:79: Warning: ‘g_p_ia_beta.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_grad.F:919:33: 919 | DEALLOCATE (G_P_ia_beta) | ^ Warning: ‘g_p_ia_beta.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_grad.F:317:119: 317 | G_P_ia_beta(L_counter), matrix_P_inu_beta, mo_coeff_v_beta, mo_coeff_o_beta) | ^ Warning: ‘mo_coeff_v_beta’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mp2_ri_grad.mod' due to: mp2_ri_grad.o /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_grad.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod basis_set_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod realspace_grid_types.mod task_list_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_poisson_types.mod cp_fm_struct.mod pw_methods.mod input_constants.mod pw_poisson_methods.mod mp2_eri.mod qs_integrate_potential.mod kinds.mod cp_blacs_env.mod qs_collocate_density.mod cp_para_env.mod rs_pw_interface.mod base_hooks.mod util.mod mathconstants.mod ao_util.mod cp_gemm_interface.mod cp_eri_mme_interface.mod gaussian_gridlevels.mod mp2_eri_gpw.mod orbital_pointers.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rpa_communication.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/rpa_communication.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod group_dist_types.mod mp2_types.mod cp_fm_types.mod base_hooks.mod kinds.mod util.mod cp_fm_struct.mod cp_blacs_env.mod mp2_ri_grad_util.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/rpa_communication.F rpa_communication.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:35:47 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_communication.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_communication.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rpa_communication.mod' due to: rpa_communication.o /build/cp2k-Q381vr/cp2k-8.1/src/rpa_communication.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod group_dist_types.mod mp2_types.mod cp_fm_types.mod base_hooks.mod kinds.mod util.mod cp_fm_struct.mod cp_blacs_env.mod mp2_ri_grad_util.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'minimax_rpa.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/minimax/minimax_rpa.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/minimax/minimax_rpa.F minimax_rpa.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:35:51 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"minimax/minimax_rpa.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/minimax/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' minimax_rpa.F90 /build/cp2k-Q381vr/cp2k-8.1/src/minimax/minimax_rpa.F:10164:33: 10164 | E_ratio = E_ratio/1.5_dp | ^ Warning: ‘e_ratio’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/minimax/minimax_rpa.F:10129:67: 10129 | REAL(KIND=dp) :: E_ratio | ^ note: ‘e_ratio’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'minimax_rpa.mod' due to: minimax_rpa.o /build/cp2k-Q381vr/cp2k-8.1/src/minimax/minimax_rpa.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'minimax_exp_gw.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/minimax/minimax_exp_gw.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/minimax/minimax_exp_gw.F minimax_exp_gw.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:35:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"minimax/minimax_exp_gw.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/minimax/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' minimax_exp_gw.F90 /build/cp2k-Q381vr/cp2k-8.1/src/minimax/minimax_exp_gw.F:80:33: 80 | E_ratio = E_ratio/1.5_dp | ^ Warning: ‘e_ratio’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/minimax/minimax_exp_gw.F:45:67: 45 | REAL(KIND=dp) :: E_ratio | ^ note: ‘e_ratio’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'minimax_exp_gw.mod' due to: minimax_exp_gw.o /build/cp2k-Q381vr/cp2k-8.1/src/minimax/minimax_exp_gw.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mp2_grids.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mp2_grids.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod qs_environment_types.mod mp2_types.mod qs_mo_types.mod cp_fm_types.mod cp_para_env.mod base_hooks.mod kinds.mod mathconstants.mod minimax_exp.mod machine.mod minimax_rpa.mod message_passing.mod minimax_exp_gw.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mp2_grids.F mp2_grids.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:35:55 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_grids.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_grids.F90 /build/cp2k-Q381vr/cp2k-8.1/src/mp2_grids.F:489:10: 489 | IF (ABS(left_term + right_term) >= conv_param) THEN | ^ Warning: ‘left_term’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_grids.F:490:13: 490 | IF (a_scaling >= 2*num_integ_points*step) THEN | ^ Warning: ‘a_scaling’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mp2_grids.mod' due to: mp2_grids.o /build/cp2k-Q381vr/cp2k-8.1/src/mp2_grids.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod qs_environment_types.mod mp2_types.mod qs_mo_types.mod cp_fm_types.mod cp_para_env.mod base_hooks.mod kinds.mod mathconstants.mod minimax_exp.mod machine.mod minimax_rpa.mod message_passing.mod minimax_exp_gw.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mp2_laplace.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mp2_laplace.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mp2_laplace.F mp2_laplace.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:36:02 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_laplace.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_laplace.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mp2_laplace.mod' due to: mp2_laplace.o /build/cp2k-Q381vr/cp2k-8.1/src/mp2_laplace.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rpa_im_time.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/rpa_im_time.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod qs_tensors_types.mod mp2_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod kpoint_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_fm_struct.mod kinds.mod base_hooks.mod mathconstants.mod machine.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod message_passing.mod cp_dbcsr_operations.mod qs_tensors.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/rpa_im_time.F rpa_im_time.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:36:02 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_im_time.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_im_time.F90 /build/cp2k-Q381vr/cp2k-8.1/src/rpa_im_time.F:370:52: 370 | occ_O = occ_O + occ | ^ Warning: ‘occ_o’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/rpa_im_time.F:452:56: 452 | occ_M_virt = occ_M_virt + occ | ^ Warning: ‘occ_m_virt’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/rpa_im_time.F:407:54: 407 | occ_M_occ = occ_M_occ + occ | ^ Warning: ‘occ_m_occ’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/rpa_im_time.F:369:52: 369 | nze_O = nze_O + nze | ^ Warning: ‘nze_o’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/rpa_im_time.F:451:56: 451 | nze_M_virt = nze_M_virt + nze | ^ Warning: ‘nze_m_virt’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/rpa_im_time.F:406:54: 406 | nze_M_occ = nze_M_occ + nze | ^ Warning: ‘nze_m_occ’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rpa_im_time.mod' due to: rpa_im_time.o /build/cp2k-Q381vr/cp2k-8.1/src/rpa_im_time.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod qs_tensors_types.mod mp2_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod kpoint_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_fm_struct.mod kinds.mod base_hooks.mod mathconstants.mod machine.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod message_passing.mod cp_dbcsr_operations.mod qs_tensors.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rpa_gw_im_time_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_im_time_util.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod qs_tensors_types.mod mp2_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod rpa_communication.mod particle_methods.mod kinds.mod base_hooks.mod qs_integral_utils.mod message_passing.mod cp_dbcsr_operations.mod qs_tensors.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_im_time_util.F rpa_gw_im_time_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:36:13 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_gw_im_time_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_gw_im_time_util.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rpa_gw_im_time_util.mod' due to: rpa_gw_im_time_util.o /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_im_time_util.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod qs_tensors_types.mod mp2_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod rpa_communication.mod particle_methods.mod kinds.mod base_hooks.mod qs_integral_utils.mod message_passing.mod cp_dbcsr_operations.mod qs_tensors.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rpa_gw.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod qs_tensors_types.mod mp2_types.mod qs_kind_types.mod qs_ks_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod kpoint_types.mod particle_types.mod cp_cfm_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_fm_struct.mod qs_moments.mod cp_fm_diag.mod input_constants.mod kinds.mod qs_gamma2kp.mod base_hooks.mod mathconstants.mod physcon.mod qs_overlap.mod cp_fm_basic_linalg.mod cp_files.mod cp_fm_cholesky.mod cp_gemm_interface.mod qs_integral_utils.mod message_passing.mod rpa_gw_im_time_util.mod cp_dbcsr_operations.mod qs_band_structure.mod qs_neighbor_lists.mod qs_tensors.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw.F rpa_gw.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:36:19 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_gw.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_gw.F90 /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw.F:2959:63: 2959 | /REAL(degeneracy, KIND=dp) | ^ Warning: ‘first_degenerate_level’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw.F:3904:49: 3904 | qp_energy = qp_energy_old + 0.5_dp*delta | ^ Warning: ‘level_energ_gw’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw.F:3510:95: 3510 | REAL(KIND=dp) :: e_fermi, energy_val, level_energ_GW, & | ^ note: ‘level_energ_gw’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rpa_gw.mod' due to: rpa_gw.o /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod qs_tensors_types.mod mp2_types.mod qs_kind_types.mod qs_ks_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod kpoint_types.mod particle_types.mod cp_cfm_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_fm_struct.mod qs_moments.mod cp_fm_diag.mod input_constants.mod kinds.mod qs_gamma2kp.mod base_hooks.mod mathconstants.mod physcon.mod qs_overlap.mod cp_fm_basic_linalg.mod cp_files.mod cp_fm_cholesky.mod cp_gemm_interface.mod qs_integral_utils.mod message_passing.mod rpa_gw_im_time_util.mod cp_dbcsr_operations.mod qs_band_structure.mod qs_neighbor_lists.mod qs_tensors.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rpa_gw_kpoints.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_kpoints.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod kpoint_types.mod particle_types.mod cp_cfm_types.mod cp_para_types.mod qs_environment_types.mod mathlib.mod particle_methods.mod kinds.mod rpa_im_time.mod cp_cfm_basic_linalg.mod base_hooks.mod mathconstants.mod cp_fm_basic_linalg.mod qs_integral_utils.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_kpoints.F rpa_gw_kpoints.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:36:37 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_gw_kpoints.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_gw_kpoints.F90 /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_kpoints.F:793:33: 793 | SUBROUTINE trace_for_self_ener(mat_contr_W_re, mat_contr_W_im, n_level_gw, jquad, & | ^ Warning: ‘trace_for_self_ener’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_kpoints.F:916:45: 916 | SUBROUTINE trafo_I_T_R1_plus_S2_to_M_R1_S2(mat_I_muP_occ_re, mat_I_muP_virt_re, & | ^ Warning: ‘trafo_i_t_r1_plus_s2_to_m_r1_s2’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_kpoints.F:1024:34: 1024 | SUBROUTINE compute_G_real_space(mat_dm_occ_S, mat_dm_virt_S, qs_env, num_integ_points, & | ^ Warning: ‘compute_g_real_space’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_kpoints.F:1105:51: 1105 | SUBROUTINE compute_cell_vec_for_R1_plus_S2_or_R1(index_to_cell_R1_plus_S2, cell_to_index_3c, & | ^ Warning: ‘compute_cell_vec_for_r1_plus_s2_or_r1’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_kpoints.F:1213:37: 1213 | SUBROUTINE compute_cell_vec_for_R2(index_to_cell_R2, cell_to_index_R2, num_cells_R2, unit_nr, & | ^ Warning: ‘compute_cell_vec_for_r2’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_kpoints.F:301:81: 301 | weight_im*AIMAG(cfm_mat_work_2%local_data(irow, jcol)) | ^ Warning: ‘weight_re’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_kpoints.F:301:81: Warning: ‘weight_im’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rpa_gw_kpoints.mod' due to: rpa_gw_kpoints.o /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_kpoints.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod kpoint_types.mod particle_types.mod cp_cfm_types.mod cp_para_types.mod qs_environment_types.mod mathlib.mod particle_methods.mod kinds.mod rpa_im_time.mod cp_cfm_basic_linalg.mod base_hooks.mod mathconstants.mod cp_fm_basic_linalg.mod qs_integral_utils.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rpa_kpoints.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/rpa_kpoints.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod qs_environment_types.mod particle_types.mod cp_cfm_types.mod cell_types.mod cp_fm_types.mod base_hooks.mod rpa_gw_kpoints.mod kinds.mod cp_cfm_basic_linalg.mod mathconstants.mod rpa_im_time.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/rpa_kpoints.F rpa_kpoints.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:36:41 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_kpoints.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_kpoints.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rpa_kpoints.mod' due to: rpa_kpoints.o /build/cp2k-Q381vr/cp2k-8.1/src/rpa_kpoints.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod qs_environment_types.mod particle_types.mod cp_cfm_types.mod cell_types.mod cp_fm_types.mod base_hooks.mod rpa_gw_kpoints.mod kinds.mod cp_cfm_basic_linalg.mod mathconstants.mod rpa_im_time.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rpa_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/rpa_util.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod mp2_types.mod cell_types.mod cp_fm_types.mod kpoint_types.mod cp_cfm_types.mod cp_para_types.mod qs_environment_types.mod rpa_communication.mod cp_fm_struct.mod input_constants.mod mp2_laplace.mod kinds.mod cp_blacs_env.mod cp_para_env.mod base_hooks.mod mathconstants.mod machine.mod cp_fm_basic_linalg.mod cp_fm_cholesky.mod cp_gemm_interface.mod rpa_gw_kpoints.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/rpa_util.F rpa_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:36:44 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_util.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rpa_util.mod' due to: rpa_util.o /build/cp2k-Q381vr/cp2k-8.1/src/rpa_util.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod mp2_types.mod cell_types.mod cp_fm_types.mod kpoint_types.mod cp_cfm_types.mod cp_para_types.mod qs_environment_types.mod rpa_communication.mod cp_fm_struct.mod input_constants.mod mp2_laplace.mod kinds.mod cp_blacs_env.mod cp_para_env.mod base_hooks.mod mathconstants.mod machine.mod cp_fm_basic_linalg.mod cp_fm_cholesky.mod cp_gemm_interface.mod rpa_gw_kpoints.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rpa_axk.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/rpa_axk.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod mp2_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod qs_energy_types.mod qs_subsys_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod rpa_communication.mod cp_fm_struct.mod cp_fm_diag.mod hfx_energy_potential.mod kinds.mod base_hooks.mod util.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/rpa_axk.F rpa_axk.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:36:48 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_axk.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_axk.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rpa_axk.mod' due to: rpa_axk.o /build/cp2k-Q381vr/cp2k-8.1/src/rpa_axk.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod mp2_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod cp_control_types.mod qs_energy_types.mod qs_subsys_types.mod particle_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod rpa_communication.mod cp_fm_struct.mod cp_fm_diag.mod hfx_energy_potential.mod kinds.mod base_hooks.mod util.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'bse.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/bse.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod group_dist_types.mod mp2_types.mod cp_fm_types.mod base_hooks.mod rpa_communication.mod kinds.mod cp_fm_basic_linalg.mod message_passing.mod cp_fm_cholesky.mod cp_gemm_interface.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/bse.F bse.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:36:52 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"bse.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' bse.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'bse.mod' due to: bse.o /build/cp2k-Q381vr/cp2k-8.1/src/bse.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod group_dist_types.mod mp2_types.mod cp_fm_types.mod base_hooks.mod rpa_communication.mod kinds.mod cp_fm_basic_linalg.mod message_passing.mod cp_fm_cholesky.mod cp_gemm_interface.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rpa_gw_ic.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_ic.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_tensors_types.mod mp2_types.mod cp_fm_types.mod base_hooks.mod rpa_communication.mod kinds.mod physcon.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_ic.F rpa_gw_ic.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:36:55 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_gw_ic.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_gw_ic.F90 /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_ic.F:298:32: 298 | SUBROUTINE print_Neaton_value(fm_mat_M_occ, unit_nr, gw_corr_lev_occ, para_env, do_homo, do_lumo) | ^ Warning: ‘print_neaton_value’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_ic.F:359:31: 359 | SUBROUTINE update_coeff_homo(coeff_homo, fm_mat_U_occ, para_env, homo, gw_corr_lev_occ, do_lumo) | ^ Warning: ‘update_coeff_homo’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_ic.F:439:32: 439 | SUBROUTINE fill_fm_mat_M_virt(fm_mat_M_virt, mat_N_virt_dbcsr, matrix_s, Eigenval, gw_corr_lev_virt, homo, para_env) | ^ Warning: ‘fill_fm_mat_m_virt’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_ic.F:681:31: 681 | SUBROUTINE fill_fm_mat_M_occ(fm_mat_M_occ, mat_N_occ_dbcsr, matrix_s, Eigenval, gw_corr_lev_occ, homo, para_env) | ^ Warning: ‘fill_fm_mat_m_occ’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_ic.F:946:34: 946 | SUBROUTINE fill_coeff_dbcsr_occ(coeff_dbcsr, coeff, homo) | ^ Warning: ‘fill_coeff_dbcsr_occ’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_ic.F:992:35: 992 | SUBROUTINE fill_coeff_dbcsr_virt(coeff_dbcsr, coeff, homo) | ^ Warning: ‘fill_coeff_dbcsr_virt’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rpa_gw_ic.mod' due to: rpa_gw_ic.o /build/cp2k-Q381vr/cp2k-8.1/src/rpa_gw_ic.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_tensors_types.mod mp2_types.mod cp_fm_types.mod base_hooks.mod rpa_communication.mod kinds.mod physcon.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rpa_main.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/rpa_main.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod mp2_types.mod cp_fm_types.mod group_dist_types.mod kpoint_types.mod cp_cfm_types.mod cp_para_types.mod qs_environment_types.mod rpa_communication.mod cp_fm_struct.mod mp2_grids.mod input_constants.mod mp2_laplace.mod kinds.mod minimax_exp.mod cp_blacs_env.mod bibliography.mod mp2_ri_grad_util.mod rpa_im_time.mod cp_para_env.mod base_hooks.mod rpa_gw.mod util.mod mathconstants.mod rpa_kpoints.mod machine.mod cp_fm_basic_linalg.mod rpa_util.mod rpa_axk.mod bse.mod message_passing.mod rpa_gw_ic.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/rpa_main.F rpa_main.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:36:57 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_main.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_main.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rpa_main.mod' due to: rpa_main.o /build/cp2k-Q381vr/cp2k-8.1/src/rpa_main.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod mp2_types.mod cp_fm_types.mod group_dist_types.mod kpoint_types.mod cp_cfm_types.mod cp_para_types.mod qs_environment_types.mod rpa_communication.mod cp_fm_struct.mod mp2_grids.mod input_constants.mod mp2_laplace.mod kinds.mod minimax_exp.mod cp_blacs_env.mod bibliography.mod mp2_ri_grad_util.mod rpa_im_time.mod cp_para_env.mod base_hooks.mod rpa_gw.mod util.mod mathconstants.mod rpa_kpoints.mod machine.mod cp_fm_basic_linalg.mod rpa_util.mod rpa_axk.mod bse.mod message_passing.mod rpa_gw_ic.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'kpoint_coulomb_2c.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_coulomb_2c.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod kpoint_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod base_hooks.mod kinds.mod mathconstants.mod generic_shg_integrals_init.mod generic_shg_integrals.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_coulomb_2c.F kpoint_coulomb_2c.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:37:05 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kpoint_coulomb_2c.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kpoint_coulomb_2c.F90 /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_coulomb_2c.F:207:44: 207 | k_z > z_max .OR. k_z < z_min) CYCLE | ^ Warning: ‘z_min’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_coulomb_2c.F:199:77: 199 | DO k_z_outer = z_min, z_max + nkp_grid(3), 2*nkp_grid(3) | ^ Warning: ‘z_max’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_coulomb_2c.F:207:44: 207 | k_z > z_max .OR. k_z < z_min) CYCLE | ^ Warning: ‘y_min’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_coulomb_2c.F:198:74: 198 | DO j_y_outer = y_min, y_max + nkp_grid(2), 2*nkp_grid(2) | ^ Warning: ‘y_max’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_coulomb_2c.F:181:38: 181 | z_min = -factor*nkp_grid(3)/2 | ^ Warning: ‘factor’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_coulomb_2c.F:207:44: 207 | k_z > z_max .OR. k_z < z_min) CYCLE | ^ Warning: ‘x_min’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_coulomb_2c.F:197:71: 197 | DO i_x_outer = x_min, x_max + nkp_grid(1), 2*nkp_grid(1) | ^ Warning: ‘x_max’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'kpoint_coulomb_2c.mod' due to: kpoint_coulomb_2c.o /build/cp2k-Q381vr/cp2k-8.1/src/kpoint_coulomb_2c.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod kpoint_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod base_hooks.mod kinds.mod mathconstants.mod generic_shg_integrals_init.mod generic_shg_integrals.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mp2_ri_2c.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_2c.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod group_dist_types.mod cp_control_types.mod distribution_2d_types.mod kpoint_types.mod particle_types.mod cp_cfm_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod rpa_communication.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod kpoint_methods.mod cp_fm_diag.mod input_constants.mod particle_methods.mod mp2_eri.mod kinds.mod cp_blacs_env.mod kpoint_coulomb_2c.mod cp_cfm_basic_linalg.mod cp_para_env.mod base_hooks.mod qs_interactions.mod cp_fm_basic_linalg.mod libint_2c_3c.mod cp_fm_cholesky.mod cp_gemm_interface.mod constants_operator.mod cp_eri_mme_interface.mod qs_integral_utils.mod mp2_eri_gpw.mod message_passing.mod cp_dbcsr_operations.mod qs_tensors.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_2c.F mp2_ri_2c.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:37:08 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_ri_2c.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_ri_2c.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mp2_ri_2c.mod' due to: mp2_ri_2c.o /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_2c.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod group_dist_types.mod cp_control_types.mod distribution_2d_types.mod kpoint_types.mod particle_types.mod cp_cfm_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod rpa_communication.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod kpoint_methods.mod cp_fm_diag.mod input_constants.mod particle_methods.mod mp2_eri.mod kinds.mod cp_blacs_env.mod kpoint_coulomb_2c.mod cp_cfm_basic_linalg.mod cp_para_env.mod base_hooks.mod qs_interactions.mod cp_fm_basic_linalg.mod libint_2c_3c.mod cp_fm_cholesky.mod cp_gemm_interface.mod constants_operator.mod cp_eri_mme_interface.mod qs_integral_utils.mod mp2_eri_gpw.mod message_passing.mod cp_dbcsr_operations.mod qs_tensors.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mp2_integrals.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mp2_integrals.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod qs_tensors_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod group_dist_types.mod kpoint_types.mod task_list_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_poisson_types.mod cp_fm_struct.mod kpoint_methods.mod input_constants.mod particle_methods.mod mp2_eri.mod kinds.mod cp_blacs_env.mod bibliography.mod cp_para_env.mod base_hooks.mod util.mod mp2_ri_2c.mod machine.mod libint_2c_3c.mod cp_units.mod cp_eri_mme_interface.mod qs_integral_utils.mod mp2_eri_gpw.mod message_passing.mod cp_dbcsr_operations.mod qs_tensors.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mp2_integrals.F mp2_integrals.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:37:15 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_integrals.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_integrals.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mp2_integrals.mod' due to: mp2_integrals.o /build/cp2k-Q381vr/cp2k-8.1/src/mp2_integrals.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod qs_tensors_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod pw_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod group_dist_types.mod kpoint_types.mod task_list_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_poisson_types.mod cp_fm_struct.mod kpoint_methods.mod input_constants.mod particle_methods.mod mp2_eri.mod kinds.mod cp_blacs_env.mod bibliography.mod cp_para_env.mod base_hooks.mod util.mod mp2_ri_2c.mod machine.mod libint_2c_3c.mod cp_units.mod cp_eri_mme_interface.mod qs_integral_utils.mod mp2_eri_gpw.mod message_passing.mod cp_dbcsr_operations.mod qs_tensors.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'linear_systems.mod' due to: linear_systems.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mp2_cphf.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mp2_cphf.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod mp2_types.mod qs_ks_types.mod atomic_kind_types.mod pw_types.mod cp_fm_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod qs_rho_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_poisson_types.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod pw_methods.mod pw_poisson_methods.mod hfx_energy_potential.mod qs_integrate_potential.mod kinds.mod cp_blacs_env.mod qs_rho_methods.mod qs_collocate_density.mod base_hooks.mod mathconstants.mod machine.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod kahan_sum.mod mp2_eri_gpw.mod linear_systems.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mp2_cphf.F mp2_cphf.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:37:29 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_cphf.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_cphf.F90 /build/cp2k-Q381vr/cp2k-8.1/src/mp2_cphf.F:1814:27: 1814 | DEALLOCATE (Ax_ba) | ^ Warning: ‘ax_ba.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_cphf.F:1812:27: 1812 | DEALLOCATE (Ax_bb) | ^ Warning: ‘ax_bb.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_cphf.F:1813:27: 1813 | DEALLOCATE (Ax_ab) | ^ Warning: ‘ax_ab.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_cphf.F:1811:26: 1811 | DEALLOCATE (xn_b) | ^ Warning: ‘xn_b.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mp2_cphf.mod' due to: mp2_cphf.o /build/cp2k-Q381vr/cp2k-8.1/src/mp2_cphf.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod mp2_types.mod qs_ks_types.mod atomic_kind_types.mod pw_types.mod cp_fm_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod qs_rho_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_poisson_types.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod pw_methods.mod pw_poisson_methods.mod hfx_energy_potential.mod qs_integrate_potential.mod kinds.mod cp_blacs_env.mod qs_rho_methods.mod qs_collocate_density.mod base_hooks.mod mathconstants.mod machine.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod kahan_sum.mod mp2_eri_gpw.mod linear_systems.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mp2_gpw.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mp2_gpw.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod mp2_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod group_dist_types.mod cp_control_types.mod distribution_2d_types.mod kpoint_types.mod particle_types.mod qs_mo_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod distribution_1d_types.mod rpa_rse.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod mp2_gpw_method.mod input_constants.mod particle_methods.mod mp2_ri_gpw.mod mp2_ri_grad.mod kinds.mod rpa_main.mod cp_blacs_env.mod cp_para_env.mod base_hooks.mod mp2_integrals.mod machine.mod qs_interactions.mod libint_wrapper.mod cp_log_handling.mod distribution_methods.mod qs_integral_utils.mod mp2_cphf.mod message_passing.mod cp_dbcsr_operations.mod qs_neighbor_lists.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mp2_gpw.F mp2_gpw.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:37:42 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_gpw.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_gpw.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mp2_gpw.mod' due to: mp2_gpw.o /build/cp2k-Q381vr/cp2k-8.1/src/mp2_gpw.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod mp2_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod group_dist_types.mod cp_control_types.mod distribution_2d_types.mod kpoint_types.mod particle_types.mod qs_mo_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod distribution_1d_types.mod rpa_rse.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod mp2_gpw_method.mod input_constants.mod particle_methods.mod mp2_ri_gpw.mod mp2_ri_grad.mod kinds.mod rpa_main.mod cp_blacs_env.mod cp_para_env.mod base_hooks.mod mp2_integrals.mod machine.mod qs_interactions.mod libint_wrapper.mod cp_log_handling.mod distribution_methods.mod qs_integral_utils.mod mp2_cphf.mod message_passing.mod cp_dbcsr_operations.mod qs_neighbor_lists.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mp2_ri_libint.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_libint.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod mp2_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod cp_fm_struct.mod gamma.mod cp_fm_diag.mod hfx_screening_methods.mod input_constants.mod hfx_energy_potential.mod t_sh_p_s_c.mod kinds.mod cp_blacs_env.mod base_hooks.mod libint_wrapper.mod cp_fm_basic_linalg.mod cp_files.mod cp_fm_cholesky.mod hfx_pair_list_methods.mod orbital_pointers.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_libint.F mp2_ri_libint.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:37:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_ri_libint.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_ri_libint.F90 /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_libint.F:1311:3: 1311 | FUNCTION calc_cond_num(matrix, size_matrix) RESULT(cond_num) | ^ Warning: ‘calc_cond_num’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mp2_ri_libint.mod' due to: mp2_ri_libint.o /build/cp2k-Q381vr/cp2k-8.1/src/mp2_ri_libint.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod mp2_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod cp_fm_struct.mod gamma.mod cp_fm_diag.mod hfx_screening_methods.mod input_constants.mod hfx_energy_potential.mod t_sh_p_s_c.mod kinds.mod cp_blacs_env.mod base_hooks.mod libint_wrapper.mod cp_fm_basic_linalg.mod cp_files.mod cp_fm_cholesky.mod hfx_pair_list_methods.mod orbital_pointers.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mp2_direct_method.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mp2_direct_method.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod mp2_types.mod cell_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod mp2_ri_libint.mod input_constants.mod hfx_energy_potential.mod t_sh_p_s_c.mod kinds.mod base_hooks.mod mathconstants.mod hfx_load_balance_methods.mod libint_wrapper.mod cp_log_handling.mod hfx_pair_list_methods.mod orbital_pointers.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mp2_direct_method.F mp2_direct_method.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:38:02 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_direct_method.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_direct_method.F90 /build/cp2k-Q381vr/cp2k-8.1/src/mp2_direct_method.F:978:64: 978 | R_start, Rsize_rec, s, S_global, S_offset, S_offset_rec, Ssize_rec | ^ Warning: ‘s_offset_rec’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_direct_method.F:977:93: 977 | index_proc_shift, j, n, proc_receive, proc_send, r, R_global, R_offset, R_offset_rec, & | ^ Warning: ‘r_offset_rec’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_direct_method.F:742:87: 742 | BIb_RS_mat_rec(1:dimen, Rsize_rec + 1:Rsize_rec + Ssize_rec) | ^ Warning: ‘ssize_rec’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_direct_method.F:126:21: 126 | S_offset_rec, same_size_kl_index, sphi_a_u1, sphi_a_u2, sphi_a_u3, sphi_b_u1, sphi_b_u2, & | ^ Warning: ‘s_offset_rec’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_direct_method.F:125:86: 125 | primitive_counter, proc_num, proc_receive, proc_send, R_offset_rec, Rsize_rec, & | ^ Warning: ‘rsize_rec’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_direct_method.F:125:75: 125 | primitive_counter, proc_num, proc_receive, proc_send, R_offset_rec, Rsize_rec, & | ^ Warning: ‘r_offset_rec’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_direct_method.F:562:96: 562 | task_counter_RS(global_counter, 4) = task_counter_RS(global_counter, 4) + 1 | ^ Warning: ‘global_counter’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mp2_direct_method.mod' due to: mp2_direct_method.o /build/cp2k-Q381vr/cp2k-8.1/src/mp2_direct_method.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod mp2_types.mod cell_types.mod particle_types.mod cp_para_types.mod qs_environment_types.mod mp2_ri_libint.mod input_constants.mod hfx_energy_potential.mod t_sh_p_s_c.mod kinds.mod base_hooks.mod mathconstants.mod hfx_load_balance_methods.mod libint_wrapper.mod cp_log_handling.mod hfx_pair_list_methods.mod orbital_pointers.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mp2_optimize_ri_basis.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mp2_optimize_ri_basis.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod mp2_types.mod qs_kind_types.mod atomic_kind_types.mod basis_set_types.mod basis_set_container_types.mod cp_para_types.mod qs_environment_types.mod mp2_ri_libint.mod kinds.mod mp2_direct_method.mod cp_para_env.mod base_hooks.mod orbital_symbols.mod util.mod machine.mod libint_wrapper.mod cp_log_handling.mod memory_utilities.mod orbital_pointers.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mp2_optimize_ri_basis.F mp2_optimize_ri_basis.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:38:16 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_optimize_ri_basis.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_optimize_ri_basis.F90 /build/cp2k-Q381vr/cp2k-8.1/src/mp2_optimize_ri_basis.F:942:87: 942 | max_min_exp_per_l(1, la) = MAX(max_min_exp_per_l(1, la), exp_limits(1, ikind)) | ^ Warning: ‘la’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2_optimize_ri_basis.F:892:68: 892 | iset, la | ^ note: ‘la’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mp2_optimize_ri_basis.mod' due to: mp2_optimize_ri_basis.o /build/cp2k-Q381vr/cp2k-8.1/src/mp2_optimize_ri_basis.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod mp2_types.mod qs_kind_types.mod atomic_kind_types.mod basis_set_types.mod basis_set_container_types.mod cp_para_types.mod qs_environment_types.mod mp2_ri_libint.mod kinds.mod mp2_direct_method.mod cp_para_env.mod base_hooks.mod orbital_symbols.mod util.mod machine.mod libint_wrapper.mod cp_log_handling.mod memory_utilities.mod orbital_pointers.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mp2.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mp2.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod admm_types.mod mp2_types.mod qs_scf_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cp_fm_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod kpoint_types.mod qs_rho_types.mod particle_types.mod cp_cfm_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod qs_matrix_pools.mod kpoint_methods.mod admm_utils.mod cp_fm_diag.mod mp2_gpw.mod input_constants.mod hfx_energy_potential.mod kinds.mod cp_blacs_env.mod bibliography.mod cp_output_handling.mod mp2_direct_method.mod cp_cfm_basic_linalg.mod cp_para_env.mod base_hooks.mod admm_methods.mod mathconstants.mod physcon.mod machine.mod cp_fm_basic_linalg.mod mp2_optimize_ri_basis.mod cp_files.mod cp_fm_cholesky.mod cp_log_handling.mod qs_ks_methods.mod qs_scf_methods.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mp2.F mp2.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:38:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2.F90 /build/cp2k-Q381vr/cp2k-8.1/src/mp2.F:1080:45: 1080 | j_batch_start = my_J_occupied_start - 1 | ^ Warning: ‘my_j_occupied_start’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2.F:1017:94: 1017 | my_J_occupied_end = my_J_occupied_start + vector_batch_J_size_group(j_group_counter) - 1 | ^ Warning: ‘j_group_counter’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2.F:950:53: 950 | number_i_subset = number_groups/number_j_subset | ^ Warning: ‘number_j_subset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2.F:1752:65: 1752 | DO n_level_gw = 1, gw_corr_lev_occ + gw_corr_lev_virt | ^ Warning: ‘gw_corr_lev_virt’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2.F:1313:39: 1313 | INTEGER :: dimen, gw_corr_lev_occ, gw_corr_lev_virt, handle, homo, i_img, ikp, irep, ispin, & | ^ Warning: ‘gw_corr_lev_occ’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2.F:1554:36: 1554 | energy%total = energy_total | ^ Warning: ‘energy_total’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2.F:1552:49: 1552 | energy%exc1_aux_fit = energy_exc_aux_fit | ^ Warning: ‘energy_exc_aux_fit’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2.F:1553:40: 1553 | energy%ex = energy_exc1_aux_fit | ^ Warning: ‘energy_exc1_aux_fit’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2.F:1550:34: 1550 | energy%exc1 = energy_exc1 | ^ Warning: ‘energy_exc1’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2.F:1549:32: 1549 | energy%exc = energy_exc | ^ Warning: ‘energy_exc’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2.F:1574:13: 1574 | IF (charge_constrain_tmp) THEN | ^ Warning: ‘charge_constrain_tmp’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mp2.F:772:38: 772 | IF (n_threads == 1 .OR. actual_x_data%memory_parameter%do_disk_storage) do_dynamic_load_balancing = .FALSE. | ^ Warning: ‘n_threads’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mp2.mod' due to: mp2.o /build/cp2k-Q381vr/cp2k-8.1/src/mp2.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod admm_types.mod mp2_types.mod qs_scf_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cp_fm_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod kpoint_types.mod qs_rho_types.mod particle_types.mod cp_cfm_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod qs_matrix_pools.mod kpoint_methods.mod admm_utils.mod cp_fm_diag.mod mp2_gpw.mod input_constants.mod hfx_energy_potential.mod kinds.mod cp_blacs_env.mod bibliography.mod cp_output_handling.mod mp2_direct_method.mod cp_cfm_basic_linalg.mod cp_para_env.mod base_hooks.mod admm_methods.mod mathconstants.mod physcon.mod machine.mod cp_fm_basic_linalg.mod mp2_optimize_ri_basis.mod cp_files.mod cp_fm_cholesky.mod cp_log_handling.mod qs_ks_methods.mod qs_scf_methods.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xas_tdp_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod distribution_2d_types.mod qs_ot_types.mod input_section_types.mod cp_para_types.mod qs_loc_types.mod mathlib.mod cp_array_utils.mod input_constants.mod kinds.mod cp_para_env.mod base_hooks.mod physcon.mod libint_wrapper.mod cp_files.mod libint_2c_3c.mod qs_grid_atom.mod qs_harmonics_atom.mod memory_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_types.F xas_tdp_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:38:37 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_tdp_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_tdp_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xas_tdp_types.mod' due to: xas_tdp_types.o /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod distribution_2d_types.mod qs_ot_types.mod input_section_types.mod cp_para_types.mod qs_loc_types.mod mathlib.mod cp_array_utils.mod input_constants.mod kinds.mod cp_para_env.mod base_hooks.mod physcon.mod libint_wrapper.mod cp_files.mod libint_2c_3c.mod qs_grid_atom.mod qs_harmonics_atom.mod memory_utilities.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xas_tdp_kernel.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_kernel.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod qs_environment_types.mod xas_tdp_types.mod distribution_2d_types.mod particle_types.mod qs_kind_types.mod base_hooks.mod kinds.mod util.mod qs_integral_utils.mod message_passing.mod cp_dbcsr_operations.mod particle_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_kernel.F xas_tdp_kernel.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:38:39 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_tdp_kernel.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_tdp_kernel.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xas_tdp_kernel.mod' due to: xas_tdp_kernel.o /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_kernel.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod qs_environment_types.mod xas_tdp_types.mod distribution_2d_types.mod particle_types.mod qs_kind_types.mod base_hooks.mod kinds.mod util.mod qs_integral_utils.mod message_passing.mod cp_dbcsr_operations.mod particle_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xas_tdp_correction.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_correction.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 admm_types.mod cp_fm_types.mod cp_control_types.mod cp_cfm_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod xas_tdp_types.mod qs_environment_types.mod cp_fm_struct.mod cp_array_utils.mod admm_utils.mod cp_fm_diag.mod kinds.mod cp_blacs_env.mod bibliography.mod xas_tdp_kernel.mod base_hooks.mod util.mod cp_cfm_diag.mod physcon.mod machine.mod cp_gemm_interface.mod cp_log_handling.mod qs_ks_methods.mod hfx_admm_utils.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_correction.F xas_tdp_correction.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:38:45 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_tdp_correction.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_tdp_correction.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_correction.F:516:46: 516 | nbatch_occ = MAX(1, nblk_occ/batch_size) | ^ Warning: ‘nblk_occ’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_correction.F:517:48: 517 | nbatch_virt = MAX(1, nblk_virt/batch_size) | ^ Warning: ‘nblk_virt’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xas_tdp_correction.mod' due to: xas_tdp_correction.o /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_correction.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 admm_types.mod cp_fm_types.mod cp_control_types.mod cp_cfm_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod xas_tdp_types.mod qs_environment_types.mod cp_fm_struct.mod cp_array_utils.mod admm_utils.mod cp_fm_diag.mod kinds.mod cp_blacs_env.mod bibliography.mod xas_tdp_kernel.mod base_hooks.mod util.mod cp_cfm_diag.mod physcon.mod machine.mod cp_gemm_interface.mod cp_log_handling.mod qs_ks_methods.mod hfx_admm_utils.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xas_tdp_integrals.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_integrals.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod distribution_2d_types.mod eri_mme_types.mod particle_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod xas_tdp_types.mod qs_neighbor_list_types.mod qs_o3c_types.mod distribution_1d_types.mod mathlib.mod gamma.mod cp_array_utils.mod ai_contraction_sphi.mod input_constants.mod particle_methods.mod kinds.mod cp_blacs_env.mod generic_os_integrals.mod base_hooks.mod libint_wrapper.mod eri_mme_integrate.mod cp_files.mod libint_2c_3c.mod constants_operator.mod cp_eri_mme_interface.mod qs_integral_utils.mod orbital_pointers.mod message_passing.mod cp_dbcsr_operations.mod t_c_g0.mod qs_neighbor_lists.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_integrals.F xas_tdp_integrals.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:39:00 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_tdp_integrals.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_tdp_integrals.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_integrals.F:486:96: 486 | !$OMP iabc,sabc,jset,kset,ncob,ncoc,sgfb,sgfc,egfb,egfc,sabc_ext,cpp_buffer,ccp_buffer) | ^ Warning: ‘my_eps_screen’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xas_tdp_integrals.mod' due to: xas_tdp_integrals.o /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_integrals.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod atomic_kind_types.mod cell_types.mod basis_set_types.mod distribution_2d_types.mod eri_mme_types.mod particle_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod xas_tdp_types.mod qs_neighbor_list_types.mod qs_o3c_types.mod distribution_1d_types.mod mathlib.mod gamma.mod cp_array_utils.mod ai_contraction_sphi.mod input_constants.mod particle_methods.mod kinds.mod cp_blacs_env.mod generic_os_integrals.mod base_hooks.mod libint_wrapper.mod eri_mme_integrate.mod cp_files.mod libint_2c_3c.mod constants_operator.mod cp_eri_mme_interface.mod qs_integral_utils.mod orbital_pointers.mod message_passing.mod cp_dbcsr_operations.mod t_c_g0.mod qs_neighbor_lists.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xas_tdp_atom.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod qs_kind_types.mod cell_types.mod basis_set_types.mod cp_control_types.mod xc_derivative_types.mod qs_rho_types.mod particle_types.mod input_section_types.mod cp_para_types.mod xas_tdp_types.mod qs_environment_types.mod qs_neighbor_list_types.mod xc_derivative_set_types.mod xc_rho_set_types.mod mathlib.mod cp_array_utils.mod xas_tdp_integrals.mod xc_atom.mod input_constants.mod ai_contraction_sphi.mod particle_methods.mod spherical_harmonics.mod kinds.mod atom_operators.mod cp_blacs_env.mod cp_para_env.mod base_hooks.mod util.mod mathconstants.mod physcon.mod lebedev.mod qs_overlap.mod xc.mod libint_2c_3c.mod qs_grid_atom.mod qs_harmonics_atom.mod cp_log_handling.mod memory_utilities.mod orbital_transformation_matrices.mod qs_integral_utils.mod orbital_pointers.mod message_passing.mod cp_dbcsr_cholesky.mod xc_derivatives.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F xas_tdp_atom.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:39:09 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_tdp_atom.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_tdp_atom.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:414:58: 414 | grid_atom%rad(1:new_nr) = grid_atom%rad(first_ir:nr) | ^ Warning: ‘first_ir’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:396:68: 396 | INTEGER :: first_ir, ir, llmax_p1, na, new_nr, nr | ^ note: ‘first_ir’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1132:63: 1132 | REAL(dp), ALLOCATABLE, DIMENSION(:, :, :) :: dso | ^ Warning: ‘dso.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1133:70: 1133 | REAL(dp), DIMENSION(:, :), POINTER :: dgr1, dgr2, ga, gr, ri_sphi_so, zet | ^ Warning: ‘dgr2.dim[1].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1133:70: Warning: ‘dgr2.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1133:70: Warning: ‘dgr2.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1133:70: Warning: ‘dgr2.dim[0].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1133:70: Warning: ‘dgr2.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1228:85: 1228 | dgr2(:, iso_proc:iso_proc), nr, 1.0_dp, dso(:, :, dir), na) | ^ Warning: ‘dgr2.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1133:64: 1133 | REAL(dp), DIMENSION(:, :), POINTER :: dgr1, dgr2, ga, gr, ri_sphi_so, zet | ^ Warning: ‘dgr1.dim[1].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1133:64: Warning: ‘dgr1.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1133:64: Warning: ‘dgr1.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1133:64: Warning: ‘dgr1.dim[0].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1133:64: Warning: ‘dgr1.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1226:85: 1226 | dgr1(:, iso_proc:iso_proc), nr, 0.0_dp, dso(:, :, dir), na) | ^ Warning: ‘dgr1.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1134:70: 1134 | REAL(dp), DIMENSION(:, :, :), POINTER :: dga1, dga2, rhoa, rhob | ^ Warning: ‘dga2.dim[2].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1134:70: Warning: ‘dga2.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1134:70: Warning: ‘dga2.dim[1].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1134:70: Warning: ‘dga2.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1134:70: Warning: ‘dga2.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1134:70: Warning: ‘dga2.dim[0].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1134:70: Warning: ‘dga2.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1134:64: 1134 | REAL(dp), DIMENSION(:, :, :), POINTER :: dga1, dga2, rhoa, rhob | ^ Warning: ‘dga1.dim[2].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1134:64: Warning: ‘dga1.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1134:64: Warning: ‘dga1.dim[1].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1134:64: Warning: ‘dga1.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1134:64: Warning: ‘dga1.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1134:64: Warning: ‘dga1.dim[0].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1134:64: Warning: ‘dga1.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1315:68: 1315 | REAL(dp), ALLOCATABLE, DIMENSION(:, :, :) :: co, dsgf, pos | ^ Warning: ‘dsgf.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1315:68: Warning: ‘dsgf.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1315:68: Warning: ‘dsgf.dim[1].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1315:68: Warning: ‘dsgf.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1553:37: 1553 | IF (do_gga) dsgf = 0.0_dp | ^ Warning: ‘dsgf.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1315:68: 1315 | REAL(dp), ALLOCATABLE, DIMENSION(:, :, :) :: co, dsgf, pos | ^ note: ‘dsgf.dim[0].ubound’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F:1315:68: Warning: ‘dsgf.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xas_tdp_atom.mod' due to: xas_tdp_atom.o /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_atom.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod qs_kind_types.mod cell_types.mod basis_set_types.mod cp_control_types.mod xc_derivative_types.mod qs_rho_types.mod particle_types.mod input_section_types.mod cp_para_types.mod xas_tdp_types.mod qs_environment_types.mod qs_neighbor_list_types.mod xc_derivative_set_types.mod xc_rho_set_types.mod mathlib.mod cp_array_utils.mod xas_tdp_integrals.mod xc_atom.mod input_constants.mod ai_contraction_sphi.mod particle_methods.mod spherical_harmonics.mod kinds.mod atom_operators.mod cp_blacs_env.mod cp_para_env.mod base_hooks.mod util.mod mathconstants.mod physcon.mod lebedev.mod qs_overlap.mod xc.mod libint_2c_3c.mod qs_grid_atom.mod qs_harmonics_atom.mod cp_log_handling.mod memory_utilities.mod orbital_transformation_matrices.mod qs_integral_utils.mod orbital_pointers.mod message_passing.mod cp_dbcsr_cholesky.mod xc_derivatives.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xas_tdp_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod preconditioner_types.mod cp_cfm_types.mod qs_mo_types.mod cp_para_types.mod xas_tdp_types.mod qs_environment_types.mod mathlib.mod cp_fm_struct.mod cp_fm_diag.mod qs_mo_methods.mod input_constants.mod kinds.mod cp_blacs_env.mod xas_tdp_kernel.mod cp_dbcsr_diag.mod cp_cfm_basic_linalg.mod base_hooks.mod cp_cfm_diag.mod physcon.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod qs_ot_eigensolver.mod cp_log_handling.mod cp_dbcsr_cholesky.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_utils.F xas_tdp_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:39:40 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_tdp_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_tdp_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xas_tdp_utils.mod' due to: xas_tdp_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod preconditioner_types.mod cp_cfm_types.mod qs_mo_types.mod cp_para_types.mod xas_tdp_types.mod qs_environment_types.mod mathlib.mod cp_fm_struct.mod cp_fm_diag.mod qs_mo_methods.mod input_constants.mod kinds.mod cp_blacs_env.mod xas_tdp_kernel.mod cp_dbcsr_diag.mod cp_cfm_basic_linalg.mod base_hooks.mod cp_cfm_diag.mod physcon.mod cp_fm_basic_linalg.mod cp_gemm_interface.mod qs_ot_eigensolver.mod cp_log_handling.mod cp_dbcsr_cholesky.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xas_tdp_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_scf_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod qs_rho_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_loc_types.mod qs_environment_types.mod xas_tdp_types.mod parallel_rng_types.mod mathlib.mod input_cp2k_dft.mod xas_tdp_correction.mod cp_fm_struct.mod admm_utils.mod cp_fm_diag.mod xas_tdp_integrals.mod qs_loc_utils.mod xc_write_output.mod qs_mo_methods.mod input_constants.mod particle_methods.mod xas_methods.mod kinds.mod cp_blacs_env.mod cp_output_handling.mod periodic_table.mod base_hooks.mod xas_tdp_atom.mod util.mod qs_operators_ao.mod physcon.mod qs_loc_methods.mod machine.mod qs_interactions.mod libint_wrapper.mod cp_fm_basic_linalg.mod cp_files.mod qs_pdos.mod cp_gemm_interface.mod cp_log_handling.mod memory_utilities.mod xas_tdp_utils.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_methods.F xas_tdp_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:39:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_tdp_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_tdp_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_methods.F:2514:26: 2514 | nmo = SIZE(lr_evals) | ^ Warning: ‘lr_evals.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_methods.F:2514:26: Warning: ‘lr_evals.dim[0].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_methods.F:2443:68: 2443 | REAL(dp), DIMENSION(:), POINTER :: lr_evals | ^ Warning: ‘lr_evals.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_methods.F:2443:68: Warning: ‘lr_evals.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_methods.F:2612:33: 2612 | IF (nspins == 1 .AND. ndo_mo == 1) THEN | ^ Warning: ‘nspins’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_methods.F:1501:41: 1501 | ALLOCATE (my_mos(n_states, nspins)) | ^ Warning: ‘n_states’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_methods.F:2056:27: 2056 | nosc = SIZE(lr_evals) | ^ Warning: ‘lr_evals.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_methods.F:2056:27: Warning: ‘lr_evals.dim[0].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_methods.F:2105:63: 2105 | osc_str(:) = pref*2.0_dp/3.0_dp*lr_evals(:)*osc_str(:) | ^ Warning: ‘lr_evals.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_methods.F:2105:63: Warning: ‘lr_evals.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_methods.F:2054:28: 2054 | ndo_so = ndo_mo*nspins | ^ Warning: ‘nspins’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_methods.F:2170:27: 2170 | nosc = SIZE(lr_evals) | ^ Warning: ‘lr_evals.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_methods.F:2170:27: Warning: ‘lr_evals.dim[0].lbound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_methods.F:2229:100: 2229 | osc_str(:) = pref*1._dp/20._dp*a_fine**2*lr_evals(:)**3*(osc_str(:) - 1._dp/3._dp*trace(:)**2) | ^ Warning: ‘lr_evals.dim[0].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_methods.F:2229:100: Warning: ‘lr_evals.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_methods.F:2168:28: 2168 | ndo_so = ndo_mo*nspins | ^ Warning: ‘nspins’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'xas_tdp_methods.mod' due to: xas_tdp_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/xas_tdp_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_scf_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod cp_fm_types.mod basis_set_types.mod cp_control_types.mod qs_rho_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_loc_types.mod qs_environment_types.mod xas_tdp_types.mod parallel_rng_types.mod mathlib.mod input_cp2k_dft.mod xas_tdp_correction.mod cp_fm_struct.mod admm_utils.mod cp_fm_diag.mod xas_tdp_integrals.mod qs_loc_utils.mod xc_write_output.mod qs_mo_methods.mod input_constants.mod particle_methods.mod xas_methods.mod kinds.mod cp_blacs_env.mod cp_output_handling.mod periodic_table.mod base_hooks.mod xas_tdp_atom.mod util.mod qs_operators_ao.mod physcon.mod qs_loc_methods.mod machine.mod qs_interactions.mod libint_wrapper.mod cp_fm_basic_linalg.mod cp_files.mod qs_pdos.mod cp_gemm_interface.mod cp_log_handling.mod memory_utilities.mod xas_tdp_utils.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_energy_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_types.mod cp_fm_types.mod cp_control_types.mod qs_energy_types.mod kpoint_types.mod atprop_types.mod qs_rho_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod et_coupling_proj.mod cp_fm_struct.mod qs_scf.mod kpoint_methods.mod xas_methods.mod qs_integrate_potential.mod cp_external_control.mod kinds.mod qs_tddfpt2_methods.mod et_coupling.mod cp_control_utils.mod qs_linres_module.mod base_hooks.mod mp2.mod qs_ks_methods.mod xas_tdp_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy_utils.F qs_energy_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:40:08 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_energy_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_energy_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_energy_utils.mod' due to: qs_energy_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_types.mod cp_fm_types.mod cp_control_types.mod qs_energy_types.mod kpoint_types.mod atprop_types.mod qs_rho_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod et_coupling_proj.mod cp_fm_struct.mod qs_scf.mod kpoint_methods.mod xas_methods.mod qs_integrate_potential.mod cp_external_control.mod kinds.mod qs_tddfpt2_methods.mod et_coupling.mod cp_control_utils.mod qs_linres_module.mod base_hooks.mod mp2.mod qs_ks_methods.mod xas_tdp_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_energy.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod qs_environment_types.mod cp_control_types.mod base_hooks.mod dm_ls_scf.mod qs_ks_methods.mod almo_scf.mod qs_scf.mod qs_environment_methods.mod energy_corrections.mod qs_energy_init.mod qs_energy_utils.mod lri_environment_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy.F qs_energy.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:40:13 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_energy.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_energy.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_energy.mod' due to: qs_energy.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_energy.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod qs_environment_types.mod cp_control_types.mod base_hooks.mod dm_ls_scf.mod qs_ks_methods.mod almo_scf.mod qs_scf.mod qs_environment_methods.mod energy_corrections.mod qs_energy_init.mod qs_energy_utils.mod lri_environment_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_force.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_force.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_ks_types.mod lri_environment_types.mod atomic_kind_types.mod cp_fm_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod qs_rho_types.mod qs_subsys_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod se_core_matrix.mod rt_propagation_forces.mod cp_dbcsr_output.mod ri_environment_methods.mod energy_corrections.mod input_constants.mod mulliken.mod qs_energy.mod xtb_matrices.mod kinds.mod qs_dftb_dispersion.mod cp_output_handling.mod qs_scf_post_scf.mod qs_rho_methods.mod efield_utils.mod base_hooks.mod admm_methods.mod qs_external_potential.mod qs_dftb_matrices.mod qs_core_energies.mod qs_core_hamiltonian.mod cp_log_handling.mod qs_ks_methods.mod se_core_core.mod qs_environment_methods.mod dft_plus_u.mod message_passing.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_force.F qs_force.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:40:16 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_force.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_force.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_force.mod' due to: qs_force.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_force.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_ks_types.mod lri_environment_types.mod atomic_kind_types.mod cp_fm_types.mod qs_force_types.mod cp_control_types.mod virial_types.mod qs_energy_types.mod qs_rho_types.mod qs_subsys_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod se_core_matrix.mod rt_propagation_forces.mod cp_dbcsr_output.mod ri_environment_methods.mod energy_corrections.mod input_constants.mod mulliken.mod qs_energy.mod xtb_matrices.mod kinds.mod qs_dftb_dispersion.mod cp_output_handling.mod qs_scf_post_scf.mod qs_rho_methods.mod efield_utils.mod base_hooks.mod admm_methods.mod qs_external_potential.mod qs_dftb_matrices.mod qs_core_energies.mod qs_core_hamiltonian.mod cp_log_handling.mod qs_ks_methods.mod se_core_core.mod qs_environment_methods.mod dft_plus_u.mod message_passing.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmm_force.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_force.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod cell_types.mod cp_result_types.mod fist_environment_types.mod fist_energy_types.mod qs_energy_types.mod particle_types.mod input_section_types.mod cp_subsys_types.mod qs_environment_types.mod qmmm_types_low.mod qmmm_gpw_forces.mod qs_ks_qmmm_methods.mod kinds.mod cp_output_handling.mod base_hooks.mod physcon.mod cp_log_handling.mod qmmm_util.mod qmmm_links_methods.mod qmmm_gpw_energy.mod fist_force.mod cp_result_methods.mod qs_force.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_force.F qmmm_force.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:40:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_force.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_force.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmm_force.mod' due to: qmmm_force.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmm_force.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod cell_types.mod cp_result_types.mod fist_environment_types.mod fist_energy_types.mod qs_energy_types.mod particle_types.mod input_section_types.mod cp_subsys_types.mod qs_environment_types.mod qmmm_types_low.mod qmmm_gpw_forces.mod qs_ks_qmmm_methods.mod kinds.mod cp_output_handling.mod base_hooks.mod physcon.mod cp_log_handling.mod qmmm_util.mod qmmm_links_methods.mod qmmm_gpw_energy.mod fist_force.mod cp_result_methods.mod qs_force.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmmx_force.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmmx_force.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod qmmm_types.mod qs_environment_types.mod qmmm_types_low.mod qmmmx_types.mod fist_environment_types.mod particle_types.mod cell_types.mod input_section_types.mod base_hooks.mod kinds.mod qmmm_force.mod qmmm_util.mod qmmmx_util.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmmx_force.F qmmmx_force.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:40:29 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmmx_force.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmmx_force.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qmmmx_force.F:134:70: 134 | mom_conserv_n = COUNT(cur_labels >= mom_conserv_min_label) | ^ Warning: ‘mom_conserv_min_label’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmmx_force.mod' due to: qmmmx_force.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmmx_force.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod qmmm_types.mod qs_environment_types.mod qmmm_types_low.mod qmmmx_types.mod fist_environment_types.mod particle_types.mod cell_types.mod input_section_types.mod base_hooks.mod kinds.mod qmmm_force.mod qmmm_util.mod qmmmx_util.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'external_potential_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/external_potential_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod force_env_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod memory_utilities.mod fparser.mod string_utilities.mod force_fields_util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/external_potential_methods.F external_potential_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:40:32 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"external_potential_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' external_potential_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'external_potential_methods.mod' due to: external_potential_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/external_potential_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod force_env_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod memory_utilities.mod fparser.mod string_utilities.mod force_fields_util.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'constraint_3x3.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/constraint_3x3.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod atomic_kind_types.mod molecule_types.mod molecule_kind_types.mod base_hooks.mod mathlib.mod kinds.mod constraint_fxd.mod linear_systems.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/constraint_3x3.F constraint_3x3.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:40:34 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"constraint_3x3.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' constraint_3x3.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'constraint_3x3.mod' due to: constraint_3x3.o /build/cp2k-Q381vr/cp2k-8.1/src/constraint_3x3.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod atomic_kind_types.mod molecule_types.mod molecule_kind_types.mod base_hooks.mod mathlib.mod kinds.mod constraint_fxd.mod linear_systems.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'constraint_4x6.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/constraint_4x6.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod atomic_kind_types.mod molecule_types.mod molecule_kind_types.mod base_hooks.mod mathlib.mod kinds.mod constraint_fxd.mod linear_systems.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/constraint_4x6.F constraint_4x6.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:40:39 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"constraint_4x6.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' constraint_4x6.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'constraint_4x6.mod' due to: constraint_4x6.o /build/cp2k-Q381vr/cp2k-8.1/src/constraint_4x6.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod atomic_kind_types.mod molecule_types.mod molecule_kind_types.mod base_hooks.mod mathlib.mod kinds.mod constraint_fxd.mod linear_systems.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'constraint_clv.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/constraint_clv.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod particle_types.mod input_section_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod base_hooks.mod kinds.mod mathlib.mod colvar_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/constraint_clv.F constraint_clv.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:40:46 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"constraint_clv.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' constraint_clv.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'constraint_clv.mod' due to: constraint_clv.o /build/cp2k-Q381vr/cp2k-8.1/src/constraint_clv.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod particle_types.mod input_section_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod base_hooks.mod kinds.mod mathlib.mod colvar_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'constraint_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/constraint_util.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 distribution_1d_types.mod particle_types.mod virial_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod base_hooks.mod mathlib.mod kinds.mod message_passing.mod colvar_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/constraint_util.F constraint_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:40:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"constraint_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' constraint_util.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'constraint_util.mod' due to: constraint_util.o /build/cp2k-Q381vr/cp2k-8.1/src/constraint_util.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 distribution_1d_types.mod particle_types.mod virial_types.mod molecule_types.mod molecule_kind_types.mod cell_types.mod base_hooks.mod mathlib.mod kinds.mod message_passing.mod colvar_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'constraint.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/constraint.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod particle_types.mod molecule_types.mod input_section_types.mod simpar_types.mod cp_para_types.mod distribution_1d_types.mod constraint_3x3.mod input_constants.mod kinds.mod constraint_4x6.mod constraint_vsite.mod constraint_clv.mod base_hooks.mod cp_log_handling.mod memory_utilities.mod message_passing.mod constraint_util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/constraint.F constraint.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:40:53 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"constraint.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' constraint.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'constraint.mod' due to: constraint.o /build/cp2k-Q381vr/cp2k-8.1/src/constraint.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod particle_types.mod molecule_types.mod input_section_types.mod simpar_types.mod cp_para_types.mod distribution_1d_types.mod constraint_3x3.mod input_constants.mod kinds.mod constraint_4x6.mod constraint_vsite.mod constraint_clv.mod base_hooks.mod cp_log_handling.mod memory_utilities.mod message_passing.mod constraint_util.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'force_env_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/force_env_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod cp_subsys_types.mod molecule_kind_list_types.mod distribution_1d_types.mod particle_types.mod atomic_kind_list_types.mod input_section_types.mod molecule_types.mod particle_list_types.mod cell_types.mod molecule_list_types.mod base_hooks.mod constraint.mod kinds.mod constraint_util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/force_env_utils.F force_env_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:40:58 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_env_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_env_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'force_env_utils.mod' due to: force_env_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/force_env_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod cp_subsys_types.mod molecule_kind_list_types.mod distribution_1d_types.mod particle_types.mod atomic_kind_list_types.mod input_section_types.mod molecule_types.mod particle_list_types.mod cell_types.mod molecule_list_types.mod base_hooks.mod constraint.mod kinds.mod constraint_util.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'eip_silicon.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/eip_silicon.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cp_para_types.mod eip_environment_types.mod distribution_1d_types.mod atomic_kind_list_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/eip_silicon.F eip_silicon.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:41:01 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eip_silicon.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eip_silicon.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'eip_silicon.mod' due to: eip_silicon.o /build/cp2k-Q381vr/cp2k-8.1/src/eip_silicon.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cp_para_types.mod eip_environment_types.mod distribution_1d_types.mod atomic_kind_list_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'scine_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/scine_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod force_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod cell_types.mod base_hooks.mod kinds.mod physcon.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/scine_utils.F scine_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:41:08 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"scine_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' scine_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'scine_utils.mod' due to: scine_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/scine_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod force_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod cell_types.mod base_hooks.mod kinds.mod physcon.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'force_env_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/force_env_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 mixed_energy_types.mod qmmm_types.mod mixed_environment_types.mod pwdft_environment_types.mod molecule_kind_list_types.mod molecule_kind_types.mod cell_types.mod global_types.mod pw_types.mod cp_fm_types.mod nnp_environment_types.mod force_env_types.mod cp_control_types.mod cp_result_types.mod fist_environment_types.mod qmmmx_types.mod virial_types.mod cp_iter_types.mod qs_energy_types.mod atprop_types.mod eip_environment_types.mod qs_rho_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod embed_types.mod metadynamics_types.mod pw_env_types.mod particle_list_types.mod fp_methods.mod mathlib.mod optimize_embedding_potential.mod constraint_fxd.mod pw_methods.mod string_utilities.mod input_constants.mod nnp_force.mod kinds.mod pwdft_environment.mod constraint_vsite.mod mixed_cdft_methods.mod grrm_utils.mod bibliography.mod fparser.mod cp_output_handling.mod force_fields_util.mod optimize_dmfet_potential.mod restraint.mod qmmm_force.mod cp_para_env.mod base_hooks.mod mixed_environment_utils.mod physcon.mod machine.mod cp_fm_basic_linalg.mod qmmmx_force.mod external_potential_methods.mod force_env_utils.mod cp_log_handling.mod kahan_sum.mod eip_silicon.mod qmmm_util.mod scine_utils.mod fist_force.mod message_passing.mod virial_methods.mod cp_result_methods.mod qs_force.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/force_env_methods.F force_env_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:41:11 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_env_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_env_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/force_env_methods.F:568:101: 568 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: ref_pos_atom, ref_pos_core, ref_pos_shell | ^ Warning: ‘ref_pos_shell.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/force_env_methods.F:568:101: Warning: ‘ref_pos_shell.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/force_env_methods.F:2145:10: 2145 | IF (force_env%sub_force_env(cluster_subsys_num)%force_env%para_env%ionode) THEN | ^ Warning: ‘cluster_subsys_num’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/force_env_methods.F:2146:54: 2146 | energies(cluster_subsys_num) = cluster_energy | ^ Warning: ‘cluster_energy’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/force_env_methods.F:1936:94: 1936 | force_env%sub_force_env(cluster_subsys_num)%force_env%qs_env) | ^ Warning: ‘cluster_subsys_num’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/force_env_methods.F:1616:78: 1616 | INTEGER :: cluster_subsys_num, handle, & | ^ note: ‘cluster_subsys_num’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/force_env_methods.F:1979:57: 1979 | energies(cluster_subsys_num) = cluster_energy | ^ Warning: ‘cluster_energy’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/force_env_methods.F:1620:74: 1620 | REAL(KIND=dp) :: cluster_energy | ^ note: ‘cluster_energy’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'force_env_methods.mod' due to: force_env_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/force_env_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 mixed_energy_types.mod qmmm_types.mod mixed_environment_types.mod pwdft_environment_types.mod molecule_kind_list_types.mod molecule_kind_types.mod cell_types.mod global_types.mod pw_types.mod cp_fm_types.mod nnp_environment_types.mod force_env_types.mod cp_control_types.mod cp_result_types.mod fist_environment_types.mod qmmmx_types.mod virial_types.mod cp_iter_types.mod qs_energy_types.mod atprop_types.mod eip_environment_types.mod qs_rho_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod qs_environment_types.mod pw_pool_types.mod embed_types.mod metadynamics_types.mod pw_env_types.mod particle_list_types.mod fp_methods.mod mathlib.mod optimize_embedding_potential.mod constraint_fxd.mod pw_methods.mod string_utilities.mod input_constants.mod nnp_force.mod kinds.mod pwdft_environment.mod constraint_vsite.mod mixed_cdft_methods.mod grrm_utils.mod bibliography.mod fparser.mod cp_output_handling.mod force_fields_util.mod optimize_dmfet_potential.mod restraint.mod qmmm_force.mod cp_para_env.mod base_hooks.mod mixed_environment_utils.mod physcon.mod machine.mod cp_fm_basic_linalg.mod qmmmx_force.mod external_potential_methods.mod force_env_utils.mod cp_log_handling.mod kahan_sum.mod eip_silicon.mod qmmm_util.mod scine_utils.mod fist_force.mod message_passing.mod virial_methods.mod cp_result_methods.mod qs_force.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'fist_main.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/fist_main.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod cp_subsys_types.mod cp_para_types.mod qmmm_types_low.mod fist_environment_types.mod input_section_types.mod global_types.mod base_hooks.mod fist_environment.mod force_env_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/fist_main.F fist_main.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:41:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_main.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_main.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'fist_main.mod' due to: fist_main.o /build/cp2k-Q381vr/cp2k-8.1/src/fist_main.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod cp_subsys_types.mod cp_para_types.mod qmmm_types_low.mod fist_environment_types.mod input_section_types.mod global_types.mod base_hooks.mod fist_environment.mod force_env_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'f77_interface.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/f77_interface.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod mixed_environment_types.mod pwdft_environment_types.mod fp_types.mod cell_types.mod global_types.mod nnp_environment_types.mod force_env_types.mod cp_result_types.mod qmmmx_types.mod virial_types.mod timings_types.mod eip_environment_types.mod input_enumeration_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod qs_environment_types.mod input_keyword_types.mod embed_types.mod metadynamics_types.mod timings.mod cp2k_info.mod embed_main.mod input_constants.mod cp_error_handling.mod qs_environment.mod kinds.mod pwdft_environment.mod nnp_environment.mod bibliography.mod input_cp2k_check.mod input_cp2k_force_eval.mod cp_output_handling.mod eip_environment.mod mixed_main.mod periodic_table.mod pw_cuda.mod qmmmx_create.mod string_table.mod base_hooks.mod cp_para_env.mod environment.mod input_cp2k_read.mod machine.mod metadynamics_utils.mod reference_manager.mod cp_files.mod force_env_methods.mod cp_log_handling.mod qmmm_create.mod fist_main.mod message_passing.mod grid_api.mod cp_result_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/f77_interface.F f77_interface.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:41:30 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"f77_interface.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' f77_interface.F90 /build/cp2k-Q381vr/cp2k-8.1/src/f77_interface.F:1170:21: 1170 | SUBROUTINE get_vel(env_id, vel, n_el, ierr) | ^ Warning: ‘get_vel’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'f77_interface.mod' due to: f77_interface.o /build/cp2k-Q381vr/cp2k-8.1/src/f77_interface.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod mixed_environment_types.mod pwdft_environment_types.mod fp_types.mod cell_types.mod global_types.mod nnp_environment_types.mod force_env_types.mod cp_result_types.mod qmmmx_types.mod virial_types.mod timings_types.mod eip_environment_types.mod input_enumeration_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod qs_environment_types.mod input_keyword_types.mod embed_types.mod metadynamics_types.mod timings.mod cp2k_info.mod embed_main.mod input_constants.mod cp_error_handling.mod qs_environment.mod kinds.mod pwdft_environment.mod nnp_environment.mod bibliography.mod input_cp2k_check.mod input_cp2k_force_eval.mod cp_output_handling.mod eip_environment.mod mixed_main.mod periodic_table.mod pw_cuda.mod qmmmx_create.mod string_table.mod base_hooks.mod cp_para_env.mod environment.mod input_cp2k_read.mod machine.mod metadynamics_utils.mod reference_manager.mod cp_files.mod force_env_methods.mod cp_log_handling.mod qmmm_create.mod fist_main.mod message_passing.mod grid_api.mod cp_result_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'replica_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/replica_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_result_types.mod qs_wf_history_types.mod cp_para_env.mod base_hooks.mod cp_log_handling.mod kinds.mod f77_interface.mod cp_output_handling.mod message_passing.mod cp_result_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/replica_types.F replica_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:41:37 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"replica_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' replica_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'replica_types.mod' due to: replica_types.o /build/cp2k-Q381vr/cp2k-8.1/src/replica_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_result_types.mod qs_wf_history_types.mod cp_para_env.mod base_hooks.mod cp_log_handling.mod kinds.mod f77_interface.mod cp_output_handling.mod message_passing.mod cp_result_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pint_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 replica_types.mod gle_system_types.mod parallel_rng_types.mod input_section_types.mod simpar_types.mod base_hooks.mod cp_log_handling.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_types.F pint_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:41:40 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pint_types.mod' due to: pint_types.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 replica_types.mod gle_system_types.mod parallel_rng_types.mod input_section_types.mod simpar_types.mod base_hooks.mod cp_log_handling.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pint_staging.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_staging.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod pint_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_staging.F pint_staging.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:41:41 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_staging.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_staging.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_staging.F:96:28: 96 | SUBROUTINE staging_retain(staging_env) | ^ Warning: ‘staging_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pint_staging.mod' due to: pint_staging.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_staging.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod pint_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pint_normalmode.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_normalmode.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pint_types.mod input_section_types.mod base_hooks.mod kinds.mod mathconstants.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_normalmode.F pint_normalmode.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:41:44 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_normalmode.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_normalmode.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_normalmode.F:189:31: 189 | SUBROUTINE normalmode_retain(normalmode_env) | ^ Warning: ‘normalmode_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pint_normalmode.mod' due to: pint_normalmode.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_normalmode.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pint_types.mod input_section_types.mod base_hooks.mod kinds.mod mathconstants.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pint_transformations.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_transformations.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pint_types.mod base_hooks.mod kinds.mod pint_staging.mod input_constants.mod pint_normalmode.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_transformations.F pint_transformations.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:41:46 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_transformations.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_transformations.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pint_transformations.mod' due to: pint_transformations.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_transformations.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pint_types.mod base_hooks.mod kinds.mod pint_staging.mod input_constants.mod pint_normalmode.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_restart_rng.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_restart_rng.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod input_val_types.mod input_section_types.mod base_hooks.mod string_utilities.mod cp_linked_list_input.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_restart_rng.F input_restart_rng.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:41:48 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_restart_rng.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_restart_rng.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_restart_rng.mod' due to: input_restart_rng.o /build/cp2k-Q381vr/cp2k-8.1/src/input_restart_rng.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod input_val_types.mod input_section_types.mod base_hooks.mod string_utilities.mod cp_linked_list_input.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_restart_force_eval.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_restart_force_eval.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod input_val_types.mod molecule_kind_types.mod cell_types.mod multipole_types.mod nnp_environment_types.mod force_env_types.mod cp_control_types.mod virial_types.mod atomic_kind_list_types.mod eip_environment_types.mod molecule_types.mod input_section_types.mod molecule_list_types.mod cp_subsys_types.mod cp_para_types.mod qs_environment_types.mod distribution_1d_types.mod parallel_rng_types.mod particle_list_types.mod string_utilities.mod cp_linked_list_input.mod input_constants.mod kinds.mod base_hooks.mod input_cp2k_restarts_util.mod cp_files.mod qmmm_ff_fist.mod cp_units.mod input_restart_rng.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_restart_force_eval.F input_restart_force_eval.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:41:48 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_restart_force_eval.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_restart_force_eval.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_restart_force_eval.mod' due to: input_restart_force_eval.o /build/cp2k-Q381vr/cp2k-8.1/src/input_restart_force_eval.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod input_val_types.mod molecule_kind_types.mod cell_types.mod multipole_types.mod nnp_environment_types.mod force_env_types.mod cp_control_types.mod virial_types.mod atomic_kind_list_types.mod eip_environment_types.mod molecule_types.mod input_section_types.mod molecule_list_types.mod cp_subsys_types.mod cp_para_types.mod qs_environment_types.mod distribution_1d_types.mod parallel_rng_types.mod particle_list_types.mod string_utilities.mod cp_linked_list_input.mod input_constants.mod kinds.mod base_hooks.mod input_cp2k_restarts_util.mod cp_files.mod qmmm_ff_fist.mod cp_units.mod input_restart_rng.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_restarts.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/input_cp2k_restarts.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 helium_types.mod neb_types.mod molecule_kind_list_types.mod input_val_types.mod md_environment_types.mod force_env_types.mod csvr_system_types.mod gle_system_types.mod atomic_kind_list_types.mod al_system_types.mod pint_types.mod averages_types.mod particle_types.mod input_section_types.mod simpar_types.mod molecule_list_types.mod cp_subsys_types.mod cp_para_types.mod thermostat_types.mod metadynamics_types.mod parallel_rng_types.mod extended_system_types.mod particle_list_types.mod cp2k_info.mod string_utilities.mod cp_linked_list_input.mod input_constants.mod thermostat_utils.mod kinds.mod pint_transformations.mod cp_output_handling.mod base_hooks.mod physcon.mod input_restart_force_eval.mod cp_log_handling.mod memory_utilities.mod input_restart_rng.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/input_cp2k_restarts.F input_cp2k_restarts.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:41:51 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/input_cp2k_restarts.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_restarts.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_restarts.mod' due to: input_cp2k_restarts.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/input_cp2k_restarts.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 helium_types.mod neb_types.mod molecule_kind_list_types.mod input_val_types.mod md_environment_types.mod force_env_types.mod csvr_system_types.mod gle_system_types.mod atomic_kind_list_types.mod al_system_types.mod pint_types.mod averages_types.mod particle_types.mod input_section_types.mod simpar_types.mod molecule_list_types.mod cp_subsys_types.mod cp_para_types.mod thermostat_types.mod metadynamics_types.mod parallel_rng_types.mod extended_system_types.mod particle_list_types.mod cp2k_info.mod string_utilities.mod cp_linked_list_input.mod input_constants.mod thermostat_utils.mod kinds.mod pint_transformations.mod cp_output_handling.mod base_hooks.mod physcon.mod input_restart_force_eval.mod cp_log_handling.mod memory_utilities.mod input_restart_rng.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rt_hfx_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_hfx_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_rho_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_ks_types.mod rt_propagation_types.mod base_hooks.mod kinds.mod cp_dbcsr_cp2k_link.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_hfx_utils.F rt_hfx_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:03 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"emd/rt_hfx_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/emd/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_hfx_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rt_hfx_utils.mod' due to: rt_hfx_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/emd/rt_hfx_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_rho_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_ks_types.mod rt_propagation_types.mod base_hooks.mod kinds.mod cp_dbcsr_cp2k_link.mod cp_dbcsr_operations.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'rt_propagation.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/rt_propagation.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod md_environment_types.mod global_types.mod cp_fm_types.mod force_env_types.mod cp_control_types.mod qs_energy_types.mod cp_fm_pool_types.mod rt_propagation_types.mod qs_mo_types.mod input_section_types.mod qs_environment_types.mod pw_env_types.mod rt_delta_pulse.mod qs_matrix_pools.mod rt_propagation_utils.mod rt_propagator_init.mod input_constants.mod cp_external_control.mod kinds.mod bibliography.mod cp_output_handling.mod input_cp2k_restarts.mod efield_utils.mod base_hooks.mod rt_hfx_utils.mod rt_propagation_output.mod qs_external_potential.mod machine.mod force_env_methods.mod qs_dftb_matrices.mod cp_log_handling.mod qs_ks_methods.mod rt_propagation_methods.mod qs_energy_init.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/rt_propagation.F rt_propagation.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:04 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/rt_propagation.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_propagation.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'rt_propagation.mod' due to: rt_propagation.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/rt_propagation.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod md_environment_types.mod global_types.mod cp_fm_types.mod force_env_types.mod cp_control_types.mod qs_energy_types.mod cp_fm_pool_types.mod rt_propagation_types.mod qs_mo_types.mod input_section_types.mod qs_environment_types.mod pw_env_types.mod rt_delta_pulse.mod qs_matrix_pools.mod rt_propagation_utils.mod rt_propagator_init.mod input_constants.mod cp_external_control.mod kinds.mod bibliography.mod cp_output_handling.mod input_cp2k_restarts.mod efield_utils.mod base_hooks.mod rt_hfx_utils.mod rt_propagation_output.mod qs_external_potential.mod machine.mod force_env_methods.mod qs_dftb_matrices.mod cp_log_handling.mod qs_ks_methods.mod rt_propagation_methods.mod qs_energy_init.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'glbopt_callback.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/glbopt_callback.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod cp_subsys_types.mod mdctrl_types.mod md_ener_types.mod md_environment_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/glbopt_callback.F glbopt_callback.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:10 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/glbopt_callback.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' glbopt_callback.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'glbopt_callback.mod' due to: glbopt_callback.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/glbopt_callback.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod cp_subsys_types.mod mdctrl_types.mod md_ener_types.mod md_environment_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mdctrl_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/mdctrl_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 md_environment_types.mod mdctrl_types.mod glbopt_callback.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/mdctrl_methods.F mdctrl_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:12 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mdctrl_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mdctrl_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mdctrl_methods.mod' due to: mdctrl_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/mdctrl_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 md_environment_types.mod mdctrl_types.mod glbopt_callback.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'wiener_process.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/wiener_process.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod cp_subsys_types.mod cp_para_types.mod distribution_1d_types.mod metadynamics_types.mod atomic_kind_list_types.mod parallel_rng_types.mod md_environment_types.mod particle_list_types.mod input_section_types.mod simpar_types.mod base_hooks.mod kinds.mod string_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/wiener_process.F wiener_process.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:13 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/wiener_process.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' wiener_process.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'wiener_process.mod' due to: wiener_process.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/wiener_process.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod cp_subsys_types.mod cp_para_types.mod distribution_1d_types.mod metadynamics_types.mod atomic_kind_list_types.mod parallel_rng_types.mod md_environment_types.mod particle_list_types.mod input_section_types.mod simpar_types.mod base_hooks.mod kinds.mod string_utilities.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'statistical_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/statistical_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 global_types.mod base_hooks.mod kinds.mod cp_log_handling.mod util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/statistical_methods.F statistical_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:15 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"statistical_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' statistical_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/statistical_methods.F:440:19: 440 | SUBROUTINE tests(xdata, globenv) | ^ Warning: ‘tests’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'statistical_methods.mod' due to: statistical_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/statistical_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 global_types.mod base_hooks.mod kinds.mod cp_log_handling.mod util.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'free_energy_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/free_energy_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 free_energy_types.mod force_env_types.mod cp_subsys_types.mod md_environment_types.mod input_section_types.mod simpar_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod statistical_methods.mod memory_utilities.mod fparser.mod cp_output_handling.mod string_utilities.mod input_constants.mod colvar_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/free_energy_methods.F free_energy_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:16 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/free_energy_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' free_energy_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'free_energy_methods.mod' due to: free_energy_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/free_energy_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 free_energy_types.mod force_env_types.mod cp_subsys_types.mod md_environment_types.mod input_section_types.mod simpar_types.mod base_hooks.mod cp_log_handling.mod kinds.mod mathlib.mod statistical_methods.mod memory_utilities.mod fparser.mod cp_output_handling.mod string_utilities.mod input_constants.mod colvar_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'md_util.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_util.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod md_environment_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod md_energies.mod cp_output_handling.mod input_cp2k_restarts.mod message_passing.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_util.F md_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:21 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/md_util.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' md_util.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'md_util.mod' due to: md_util.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_util.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod md_environment_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod md_energies.mod cp_output_handling.mod input_cp2k_restarts.mod message_passing.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'gopt_param_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_param_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_param_types.F gopt_param_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/gopt_param_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' gopt_param_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_param_types.F:167:31: 167 | SUBROUTINE gopt_param_retain(gopt_param) | ^ Warning: ‘gopt_param_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'gopt_param_types.mod' due to: gopt_param_types.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_param_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cell_opt_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/cell_opt_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod input_keyword_types.mod input_enumeration_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod input_constants.mod kinds.mod mathlib.mod mathconstants.mod cp_files.mod input_cp2k_global.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/cell_opt_utils.F cell_opt_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:24 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/cell_opt_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cell_opt_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/cell_opt_utils.F:146:47: 146 | new_logger%iter_info%project_name = c_val | 1 Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cell_opt_utils.mod' due to: cell_opt_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/cell_opt_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod input_keyword_types.mod input_enumeration_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod input_constants.mod kinds.mod mathlib.mod mathconstants.mod cp_files.mod input_cp2k_global.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cell_opt_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/cell_opt_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod force_env_types.mod input_section_types.mod particle_list_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cell_opt_utils.mod cp_units.mod cp_output_handling.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/cell_opt_types.F cell_opt_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:25 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/cell_opt_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cell_opt_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cell_opt_types.mod' due to: cell_opt_types.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/cell_opt_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod force_env_types.mod input_section_types.mod particle_list_types.mod cell_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cell_opt_utils.mod cp_units.mod cp_output_handling.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'gopt_f_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_f_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod cp_subsys_types.mod gopt_param_types.mod cell_opt_types.mod dimer_types.mod particle_list_types.mod input_section_types.mod global_types.mod base_hooks.mod kinds.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_f_types.F gopt_f_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/gopt_f_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' gopt_f_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'gopt_f_types.mod' due to: gopt_f_types.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_f_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod cp_subsys_types.mod gopt_param_types.mod cell_opt_types.mod dimer_types.mod particle_list_types.mod input_section_types.mod global_types.mod base_hooks.mod kinds.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'integrator_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/integrator_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod md_environment_types.mod molecule_kind_types.mod cell_types.mod shell_potential_types.mod barostat_types.mod virial_types.mod particle_types.mod molecule_types.mod simpar_types.mod cp_para_types.mod thermostat_types.mod distribution_1d_types.mod extended_system_types.mod mathlib.mod input_constants.mod kinds.mod base_hooks.mod constraint.mod message_passing.mod constraint_util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/integrator_utils.F integrator_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:28 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/integrator_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' integrator_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'integrator_utils.mod' due to: integrator_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/integrator_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod md_environment_types.mod molecule_kind_types.mod cell_types.mod shell_potential_types.mod barostat_types.mod virial_types.mod particle_types.mod molecule_types.mod simpar_types.mod cp_para_types.mod thermostat_types.mod distribution_1d_types.mod extended_system_types.mod mathlib.mod input_constants.mod kinds.mod base_hooks.mod constraint.mod message_passing.mod constraint_util.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'dimer_utils.mod' due to: dimer_utils.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cg_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/cg_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_f77_methods.f90 cp_para_types.mod gopt_f_types.mod gopt_param_types.mod dimer_types.mod global_types.mod base_hooks.mod cp_external_control.mod kinds.mod dimer_utils.mod mathconstants.mod memory_utilities.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/cg_utils.F cg_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:34 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/cg_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cg_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/cg_utils.F:810:19: 810 | IF (ABS(d) .GT. ABS(0.5_dp*olde)) skip0 = .TRUE. | ^ Warning: ‘e’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cg_utils.mod' due to: cg_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/cg_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_f77_methods.f90 cp_para_types.mod gopt_f_types.mod gopt_param_types.mod dimer_types.mod global_types.mod base_hooks.mod cp_external_control.mod kinds.mod dimer_utils.mod mathconstants.mod memory_utilities.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'gopt_f_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_f_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_f77_methods.f90 gopt_param_types.mod atomic_kind_types.mod cell_types.mod force_env_types.mod dimer_types.mod virial_types.mod atomic_kind_list_types.mod gopt_f_types.mod particle_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod distribution_1d_types.mod particle_list_types.mod qmmmx_util.mod input_constants.mod particle_methods.mod kinds.mod dimer_utils.mod input_cp2k_restarts.mod base_hooks.mod machine.mod cp_units.mod cp_log_handling.mod qmmm_util.mod motion_utils.mod virial_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_f_methods.F gopt_f_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:39 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/gopt_f_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' gopt_f_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_f_methods.F:978:14: 978 | CPASSERT((SIZE(x) == idg + 6)) | ^ Warning: ‘idg’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'gopt_f_methods.mod' due to: gopt_f_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_f_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_f77_methods.f90 gopt_param_types.mod atomic_kind_types.mod cell_types.mod force_env_types.mod dimer_types.mod virial_types.mod atomic_kind_list_types.mod gopt_f_types.mod particle_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod distribution_1d_types.mod particle_list_types.mod qmmmx_util.mod input_constants.mod particle_methods.mod kinds.mod dimer_utils.mod input_cp2k_restarts.mod base_hooks.mod machine.mod cp_units.mod cp_log_handling.mod qmmm_util.mod motion_utils.mod virial_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cg_optimizer.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/cg_optimizer.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_f77_methods.f90 force_env_types.mod cp_para_types.mod gopt_f_types.mod gopt_param_types.mod input_section_types.mod cell_types.mod global_types.mod base_hooks.mod cp_external_control.mod cp_log_handling.mod kinds.mod cg_utils.mod machine.mod cp_output_handling.mod gopt_f_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/cg_optimizer.F cg_optimizer.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:43 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/cg_optimizer.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cg_optimizer.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cg_optimizer.mod' due to: cg_optimizer.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/cg_optimizer.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_f77_methods.f90 force_env_types.mod cp_para_types.mod gopt_f_types.mod gopt_param_types.mod input_section_types.mod cell_types.mod global_types.mod base_hooks.mod cp_external_control.mod cp_log_handling.mod kinds.mod cg_utils.mod machine.mod cp_output_handling.mod gopt_f_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'shell_opt.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/shell_opt.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 gopt_param_types.mod atomic_kind_types.mod global_types.mod force_env_types.mod shell_potential_types.mod atomic_kind_list_types.mod gopt_f_types.mod particle_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod distribution_1d_types.mod input_constants.mod integrator_utils.mod kinds.mod cg_optimizer.mod cp_output_handling.mod base_hooks.mod cp_log_handling.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/shell_opt.F shell_opt.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:46 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/shell_opt.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' shell_opt.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'shell_opt.mod' due to: shell_opt.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/shell_opt.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 gopt_param_types.mod atomic_kind_types.mod global_types.mod force_env_types.mod shell_potential_types.mod atomic_kind_list_types.mod gopt_f_types.mod particle_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod distribution_1d_types.mod input_constants.mod integrator_utils.mod kinds.mod cg_optimizer.mod cp_output_handling.mod base_hooks.mod cp_log_handling.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qmmmx_update.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qmmmx_update.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod cp_subsys_types.mod qmmm_types.mod qmmmx_types.mod distribution_1d_types.mod atomic_kind_list_types.mod input_section_types.mod base_hooks.mod qmmm_create.mod input_restart_force_eval.mod qmmmx_util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qmmmx_update.F qmmmx_update.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:48 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmmx_update.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmmx_update.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qmmmx_update.mod' due to: qmmmx_update.o /build/cp2k-Q381vr/cp2k-8.1/src/qmmmx_update.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod cp_subsys_types.mod qmmm_types.mod qmmmx_types.mod distribution_1d_types.mod atomic_kind_list_types.mod input_section_types.mod base_hooks.mod qmmm_create.mod input_restart_force_eval.mod qmmmx_util.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'extended_system_dynamics.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/extended_system_dynamics.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 shell_potential_types.mod distribution_1d_types.mod particle_types.mod extended_system_types.mod atomic_kind_types.mod molecule_types.mod molecule_kind_types.mod base_hooks.mod kinds.mod thermostat_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/extended_system_dynamics.F extended_system_dynamics.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:51 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/extended_system_dynamics.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' extended_system_dynamics.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'extended_system_dynamics.mod' due to: extended_system_dynamics.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/extended_system_dynamics.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 shell_potential_types.mod distribution_1d_types.mod particle_types.mod extended_system_types.mod atomic_kind_types.mod molecule_types.mod molecule_kind_types.mod base_hooks.mod kinds.mod thermostat_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'reftraj_util.mod' due to: reftraj_util.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'csvr_system_mapping.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/csvr_system_mapping.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod csvr_system_types.mod thermostat_types.mod distribution_1d_types.mod extended_system_types.mod molecule_types.mod molecule_kind_types.mod simpar_types.mod base_hooks.mod kinds.mod thermostat_mapping.mod message_passing.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/csvr_system_mapping.F csvr_system_mapping.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:53 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/csvr_system_mapping.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' csvr_system_mapping.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'csvr_system_mapping.mod' due to: csvr_system_mapping.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/csvr_system_mapping.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod csvr_system_types.mod thermostat_types.mod distribution_1d_types.mod extended_system_types.mod molecule_types.mod molecule_kind_types.mod simpar_types.mod base_hooks.mod kinds.mod thermostat_mapping.mod message_passing.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'csvr_system_init.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/csvr_system_init.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod csvr_system_types.mod thermostat_types.mod distribution_1d_types.mod parallel_rng_types.mod molecule_types.mod molecule_kind_types.mod input_section_types.mod simpar_types.mod base_hooks.mod csvr_system_mapping.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/csvr_system_init.F csvr_system_init.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:53 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/csvr_system_init.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' csvr_system_init.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'csvr_system_init.mod' due to: csvr_system_init.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/csvr_system_init.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod csvr_system_types.mod thermostat_types.mod distribution_1d_types.mod parallel_rng_types.mod molecule_types.mod molecule_kind_types.mod input_section_types.mod simpar_types.mod base_hooks.mod csvr_system_mapping.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'al_system_dynamics.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/al_system_dynamics.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod distribution_1d_types.mod particle_types.mod extended_system_types.mod atomic_kind_types.mod molecule_types.mod molecule_kind_types.mod al_system_types.mod base_hooks.mod kinds.mod constraint_fxd.mod thermostat_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/al_system_dynamics.F al_system_dynamics.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/al_system_dynamics.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' al_system_dynamics.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/al_system_dynamics.F:290:46: 290 | map_info%v_scale(imap) = 1.0_dp | ^ Warning: ‘imap’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'al_system_dynamics.mod' due to: al_system_dynamics.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/al_system_dynamics.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod distribution_1d_types.mod particle_types.mod extended_system_types.mod atomic_kind_types.mod molecule_types.mod molecule_kind_types.mod al_system_types.mod base_hooks.mod kinds.mod constraint_fxd.mod thermostat_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'al_system_mapping.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/al_system_mapping.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod thermostat_types.mod distribution_1d_types.mod extended_system_types.mod molecule_types.mod molecule_kind_types.mod al_system_types.mod simpar_types.mod base_hooks.mod kinds.mod thermostat_mapping.mod message_passing.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/al_system_mapping.F al_system_mapping.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:57 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/al_system_mapping.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' al_system_mapping.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'al_system_mapping.mod' due to: al_system_mapping.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/al_system_mapping.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod thermostat_types.mod distribution_1d_types.mod extended_system_types.mod molecule_types.mod molecule_kind_types.mod al_system_types.mod simpar_types.mod base_hooks.mod kinds.mod thermostat_mapping.mod message_passing.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'al_system_init.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/al_system_init.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod thermostat_types.mod distribution_1d_types.mod molecule_types.mod molecule_kind_types.mod al_system_types.mod input_section_types.mod simpar_types.mod base_hooks.mod kinds.mod al_system_mapping.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/al_system_init.F al_system_init.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:57 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/al_system_init.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' al_system_init.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'al_system_init.mod' due to: al_system_init.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/al_system_init.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod thermostat_types.mod distribution_1d_types.mod molecule_types.mod molecule_kind_types.mod al_system_types.mod input_section_types.mod simpar_types.mod base_hooks.mod kinds.mod al_system_mapping.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'gle_system_dynamics.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/gle_system_dynamics.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod gle_system_types.mod thermostat_types.mod distribution_1d_types.mod parallel_rng_types.mod extended_system_types.mod particle_types.mod molecule_types.mod molecule_kind_types.mod input_section_types.mod simpar_types.mod base_hooks.mod kinds.mod thermostat_utils.mod thermostat_mapping.mod message_passing.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/gle_system_dynamics.F gle_system_dynamics.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:42:58 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/gle_system_dynamics.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' gle_system_dynamics.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'gle_system_dynamics.mod' due to: gle_system_dynamics.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/gle_system_dynamics.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod gle_system_types.mod thermostat_types.mod distribution_1d_types.mod parallel_rng_types.mod extended_system_types.mod particle_types.mod molecule_types.mod molecule_kind_types.mod input_section_types.mod simpar_types.mod base_hooks.mod kinds.mod thermostat_utils.mod thermostat_mapping.mod message_passing.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'csvr_system_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/csvr_system_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/csvr_system_utils.F csvr_system_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:43:01 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"csvr_system_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' csvr_system_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'csvr_system_utils.mod' due to: csvr_system_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/csvr_system_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'csvr_system_dynamics.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/csvr_system_dynamics.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 csvr_system_types.mod distribution_1d_types.mod parallel_rng_types.mod extended_system_types.mod particle_types.mod atomic_kind_types.mod molecule_types.mod molecule_kind_types.mod base_hooks.mod kinds.mod csvr_system_utils.mod thermostat_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/csvr_system_dynamics.F csvr_system_dynamics.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:43:01 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/csvr_system_dynamics.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' csvr_system_dynamics.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'csvr_system_dynamics.mod' due to: csvr_system_dynamics.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/csvr_system_dynamics.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 csvr_system_types.mod distribution_1d_types.mod parallel_rng_types.mod extended_system_types.mod particle_types.mod atomic_kind_types.mod molecule_types.mod molecule_kind_types.mod base_hooks.mod kinds.mod csvr_system_utils.mod thermostat_utils.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'thermostat_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod molecule_kind_list_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod global_types.mod force_env_types.mod atomic_kind_list_types.mod particle_types.mod molecule_types.mod input_section_types.mod simpar_types.mod molecule_list_types.mod cp_subsys_types.mod cp_para_types.mod thermostat_types.mod distribution_1d_types.mod extended_system_types.mod particle_list_types.mod csvr_system_init.mod input_constants.mod thermostat_utils.mod kinds.mod bibliography.mod cp_output_handling.mod extended_system_dynamics.mod base_hooks.mod al_system_dynamics.mod al_system_init.mod extended_system_init.mod gle_system_dynamics.mod cp_units.mod cp_log_handling.mod csvr_system_dynamics.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_methods.F thermostat_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:43:02 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/thermostat_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' thermostat_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'thermostat_methods.mod' due to: thermostat_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/thermostat/thermostat_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod molecule_kind_list_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod global_types.mod force_env_types.mod atomic_kind_list_types.mod particle_types.mod molecule_types.mod input_section_types.mod simpar_types.mod molecule_list_types.mod cp_subsys_types.mod cp_para_types.mod thermostat_types.mod distribution_1d_types.mod extended_system_types.mod particle_list_types.mod csvr_system_init.mod input_constants.mod thermostat_utils.mod kinds.mod bibliography.mod cp_output_handling.mod extended_system_dynamics.mod base_hooks.mod al_system_dynamics.mod al_system_init.mod extended_system_init.mod gle_system_dynamics.mod cp_units.mod cp_log_handling.mod csvr_system_dynamics.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'integrator.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/integrator.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 reftraj_types.mod molecule_kind_list_types.mod atomic_kind_types.mod md_environment_types.mod molecule_kind_types.mod cell_types.mod global_types.mod force_env_types.mod thermal_region_types.mod cp_control_types.mod barostat_types.mod atomic_kind_list_types.mod virial_types.mod particle_types.mod rt_propagation_types.mod molecule_types.mod simpar_types.mod molecule_list_types.mod cp_subsys_types.mod cp_para_types.mod qs_environment_types.mod thermostat_types.mod distribution_1d_types.mod extended_system_types.mod particle_list_types.mod metadynamics.mod mathlib.mod constraint_fxd.mod shell_opt.mod qmmmx_update.mod input_constants.mod integrator_utils.mod kinds.mod extended_system_dynamics.mod base_hooks.mod constraint.mod physcon.mod rt_propagation_output.mod reftraj_util.mod eigenvalueproblems.mod force_env_methods.mod cp_units.mod cp_log_handling.mod thermostat_methods.mod rt_propagation_methods.mod qmmm_util.mod virial_methods.mod constraint_util.mod cp_parser_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/integrator.F integrator.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:43:06 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/integrator.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' integrator.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/integrator.F:396:65: 396 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :) :: v_old | ^ Warning: ‘v_old.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'integrator.mod' due to: integrator.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/integrator.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 reftraj_types.mod molecule_kind_list_types.mod atomic_kind_types.mod md_environment_types.mod molecule_kind_types.mod cell_types.mod global_types.mod force_env_types.mod thermal_region_types.mod cp_control_types.mod barostat_types.mod atomic_kind_list_types.mod virial_types.mod particle_types.mod rt_propagation_types.mod molecule_types.mod simpar_types.mod molecule_list_types.mod cp_subsys_types.mod cp_para_types.mod qs_environment_types.mod thermostat_types.mod distribution_1d_types.mod extended_system_types.mod particle_list_types.mod metadynamics.mod mathlib.mod constraint_fxd.mod shell_opt.mod qmmmx_update.mod input_constants.mod integrator_utils.mod kinds.mod extended_system_dynamics.mod base_hooks.mod constraint.mod physcon.mod rt_propagation_output.mod reftraj_util.mod eigenvalueproblems.mod force_env_methods.mod cp_units.mod cp_log_handling.mod thermostat_methods.mod rt_propagation_methods.mod qmmm_util.mod virial_methods.mod constraint_util.mod cp_parser_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'velocity_verlet_control.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/velocity_verlet_control.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod simpar_types.mod md_environment_types.mod global_types.mod base_hooks.mod input_constants.mod integrator.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/velocity_verlet_control.F velocity_verlet_control.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:43:16 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/velocity_verlet_control.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' velocity_verlet_control.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'velocity_verlet_control.mod' due to: velocity_verlet_control.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/velocity_verlet_control.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod simpar_types.mod md_environment_types.mod global_types.mod base_hooks.mod input_constants.mod integrator.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'simpar_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/simpar_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_keyword_types.mod input_enumeration_types.mod simpar_types.mod base_hooks.mod cp_log_handling.mod kinds.mod bibliography.mod input_cp2k_md.mod cp_output_handling.mod input_constants.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/simpar_methods.F simpar_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:43:18 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/simpar_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' simpar_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'simpar_methods.mod' due to: simpar_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/simpar_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_keyword_types.mod input_enumeration_types.mod simpar_types.mod base_hooks.mod cp_log_handling.mod kinds.mod bibliography.mod input_cp2k_md.mod cp_output_handling.mod input_constants.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'md_vel_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_vel_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod atomic_kind_types.mod input_val_types.mod md_environment_types.mod molecule_kind_types.mod cell_types.mod global_types.mod force_env_types.mod thermal_region_types.mod shell_potential_types.mod atomic_kind_list_types.mod particle_types.mod input_section_types.mod simpar_types.mod cp_subsys_types.mod cp_para_types.mod parallel_rng_types.mod extended_system_types.mod md_ener_types.mod particle_list_types.mod input_cp2k_binary_restarts.mod mathlib.mod shell_opt.mod cp_linked_list_input.mod input_constants.mod kinds.mod bibliography.mod cp_output_handling.mod base_hooks.mod mathconstants.mod physcon.mod input_restart_force_eval.mod md_util.mod force_env_methods.mod cp_units.mod force_env_utils.mod cp_log_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_vel_utils.F md_vel_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:43:19 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/md_vel_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' md_vel_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_vel_utils.F:706:24: 706 | rescale_regions, shellvel_explicit, shellvel_read | ^ Warning: ‘rescale_regions’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'md_vel_utils.mod' due to: md_vel_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_vel_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod atomic_kind_types.mod input_val_types.mod md_environment_types.mod molecule_kind_types.mod cell_types.mod global_types.mod force_env_types.mod thermal_region_types.mod shell_potential_types.mod atomic_kind_list_types.mod particle_types.mod input_section_types.mod simpar_types.mod cp_subsys_types.mod cp_para_types.mod parallel_rng_types.mod extended_system_types.mod md_ener_types.mod particle_list_types.mod input_cp2k_binary_restarts.mod mathlib.mod shell_opt.mod cp_linked_list_input.mod input_constants.mod kinds.mod bibliography.mod cp_output_handling.mod base_hooks.mod mathconstants.mod physcon.mod input_restart_force_eval.mod md_util.mod force_env_methods.mod cp_units.mod force_env_utils.mod cp_log_handling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'md_run.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_run.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 reftraj_types.mod md_environment_types.mod mdctrl_types.mod cell_types.mod global_types.mod force_env_types.mod thermal_region_types.mod barostat_types.mod atomic_kind_list_types.mod virial_types.mod averages_types.mod input_section_types.mod simpar_types.mod free_energy_types.mod cp_subsys_types.mod cp_para_types.mod thermostat_types.mod distribution_1d_types.mod metadynamics_types.mod md_ener_types.mod particle_list_types.mod metadynamics.mod md_energies.mod rt_propagation.mod input_constants.mod cp_external_control.mod kinds.mod input_cp2k_check.mod cp_output_handling.mod mdctrl_methods.mod wiener_process.mod base_hooks.mod free_energy_methods.mod md_util.mod velocity_verlet_control.mod machine.mod reftraj_util.mod simpar_methods.mod force_env_methods.mod thermal_region_utils.mod cp_log_handling.mod thermostat_methods.mod qs_environment_methods.mod virial_methods.mod md_vel_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/md_run.F md_run.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:43:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/md_run.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' md_run.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pint_public.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_public.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod pint_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_public.F pint_public.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:43:33 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_public.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_public.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_public.F:80:3: 80 | FUNCTION pint_cog_pos(pint_env) RESULT(cntrd_r) | ^ Warning: ‘pint_cog_pos’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_public.F:116:35: 116 | SUBROUTINE pint_free_part_bead_x(n, t, rng_gaussian, x, nout) | ^ Warning: ‘pint_free_part_bead_x’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'replica_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/replica_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cp_para_types.mod force_env_types.mod qs_environment_types.mod replica_types.mod cp_result_types.mod cp_control_types.mod input_section_types.mod qs_wf_history_types.mod cp_para_env.mod base_hooks.mod cp_log_handling.mod f77_interface.mod kinds.mod qs_wf_history_methods.mod cp_output_handling.mod message_passing.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/replica_methods.F replica_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:43:35 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"replica_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' replica_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'replica_methods.mod' due to: replica_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/replica_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cp_para_types.mod force_env_types.mod qs_environment_types.mod replica_types.mod cp_result_types.mod cp_control_types.mod input_section_types.mod qs_wf_history_types.mod cp_para_env.mod base_hooks.mod cp_log_handling.mod f77_interface.mod kinds.mod qs_wf_history_methods.mod cp_output_handling.mod message_passing.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pint_public.mod' due to: pint_public.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'helium_common.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_common.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 helium_types.mod splines_types.mod pint_types.mod base_hooks.mod pint_public.mod kinds.mod mathconstants.mod physcon.mod memory_utilities.mod splines_methods.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_common.F helium_common.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:43:38 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/helium_common.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' helium_common.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_common.F:1468:3: 1468 | FUNCTION helium_bead_rij(helium, ia, ib, ja, jb) RESULT(rij) | ^ Warning: ‘helium_bead_rij’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_common.F:1776:3: 1776 | FUNCTION helium_total_winding_number_linkwise(helium) RESULT(wnum) | ^ Warning: ‘helium_total_winding_number_linkwise’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_common.F:1852:3: 1852 | FUNCTION helium_total_winding_number_cyclewise(helium) RESULT(wnum) | ^ Warning: ‘helium_total_winding_number_cyclewise’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_common.F:1982:3: 1982 | FUNCTION helium_total_projected_area_linkwise(helium) RESULT(area) | ^ Warning: ‘helium_total_projected_area_linkwise’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_common.F:2059:3: 2059 | FUNCTION helium_cycle_projected_area_pbc(helium, CYCLE) RESULT(area) | ^ Warning: ‘helium_cycle_projected_area_pbc’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_common.F:2118:3: 2118 | FUNCTION helium_total_projected_area_cyclewise(helium) RESULT(area) | ^ Warning: ‘helium_total_projected_area_cyclewise’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_common.F:2250:3: 2250 | FUNCTION helium_total_moment_of_inertia_linkwise(helium) RESULT(moit) | ^ Warning: ‘helium_total_moment_of_inertia_linkwise’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_common.F:2329:3: 2329 | FUNCTION helium_total_moment_of_inertia_cyclewise(helium) RESULT(moit) | ^ Warning: ‘helium_total_moment_of_inertia_cyclewise’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_common.F:2445:3: 2445 | FUNCTION helium_link_vector(helium, ia, ib) RESULT(lvec) | ^ Warning: ‘helium_link_vector’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_common.F:2479:3: 2479 | FUNCTION helium_rperpendicular(helium, ia, ib) RESULT(rperp) | ^ Warning: ‘helium_rperpendicular’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_common.F:354:31: 354 | DEALLOCATE (used_indices) | ^ Warning: ‘used_indices.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'helium_common.mod' due to: helium_common.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_common.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 helium_types.mod splines_types.mod pint_types.mod base_hooks.mod pint_public.mod kinds.mod mathconstants.mod physcon.mod memory_utilities.mod splines_methods.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'helium_interactions.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_interactions.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 helium_types.mod splines_types.mod pint_types.mod base_hooks.mod kinds.mod physcon.mod helium_common.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_interactions.F helium_interactions.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:43:46 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/helium_interactions.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' helium_interactions.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'helium_interactions.mod' due to: helium_interactions.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_interactions.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 helium_types.mod splines_types.mod pint_types.mod base_hooks.mod kinds.mod physcon.mod helium_common.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'helium_io.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_io.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 helium_types.mod cell_types.mod pint_types.mod cp_parser_types.mod input_section_types.mod cp_para_types.mod helium_interactions.mod input_constants.mod kinds.mod cp_output_handling.mod base_hooks.mod physcon.mod machine.mod cp_units.mod cp_log_handling.mod helium_common.mod memory_utilities.mod message_passing.mod cp_parser_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_io.F helium_io.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:43:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/helium_io.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' helium_io.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'helium_io.mod' due to: helium_io.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_io.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 helium_types.mod cell_types.mod pint_types.mod cp_parser_types.mod input_section_types.mod cp_para_types.mod helium_interactions.mod input_constants.mod kinds.mod cp_output_handling.mod base_hooks.mod physcon.mod machine.mod cp_units.mod cp_log_handling.mod helium_common.mod memory_utilities.mod message_passing.mod cp_parser_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'helium_worm.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_worm.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 helium_types.mod pint_types.mod base_hooks.mod kinds.mod helium_io.mod helium_common.mod helium_interactions.mod mathconstants.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_worm.F helium_worm.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:43:57 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/helium_worm.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' helium_worm.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'helium_worm.mod' due to: helium_worm.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_worm.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 helium_types.mod pint_types.mod base_hooks.mod kinds.mod helium_io.mod helium_common.mod helium_interactions.mod mathconstants.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'helium_sampling.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_sampling.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 helium_types.mod global_types.mod splines_types.mod pint_types.mod pint_public.mod helium_interactions.mod input_constants.mod helium_worm.mod cp_external_control.mod kinds.mod helium_io.mod cp_output_handling.mod input_cp2k_restarts.mod base_hooks.mod physcon.mod machine.mod cp_log_handling.mod helium_common.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_sampling.F helium_sampling.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:44:14 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/helium_sampling.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' helium_sampling.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'helium_sampling.mod' due to: helium_sampling.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_sampling.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 helium_types.mod global_types.mod splines_types.mod pint_types.mod pint_public.mod helium_interactions.mod input_constants.mod helium_worm.mod cp_external_control.mod kinds.mod helium_io.mod cp_output_handling.mod input_cp2k_restarts.mod base_hooks.mod physcon.mod machine.mod cp_log_handling.mod helium_common.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pint_pile.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_pile.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod pint_types.mod input_section_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_pile.F pint_pile.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:44:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_pile.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_pile.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pint_pile.mod' due to: pint_pile.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_pile.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod pint_types.mod input_section_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pint_io.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_io.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod force_env_types.mod input_section_types.mod particle_list_types.mod pint_types.mod cell_types.mod base_hooks.mod pint_public.mod cp_log_handling.mod f77_interface.mod kinds.mod pint_transformations.mod cp_units.mod machine.mod cp_output_handling.mod input_constants.mod particle_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_io.F pint_io.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:44:25 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_io.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_io.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pint_io.mod' due to: pint_io.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_io.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod force_env_types.mod input_section_types.mod particle_list_types.mod pint_types.mod cell_types.mod base_hooks.mod pint_public.mod cp_log_handling.mod f77_interface.mod kinds.mod pint_transformations.mod cp_units.mod machine.mod cp_output_handling.mod input_constants.mod particle_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pint_qtb.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_qtb.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod pint_types.mod input_section_types.mod base_hooks.mod fft_lib.mod cp_log_handling.mod input_constants.mod kinds.mod fft_tools.mod mathconstants.mod cp_output_handling.mod fft_plan.mod message_passing.mod cp_files.mod pint_io.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_qtb.F pint_qtb.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:44:28 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_qtb.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_qtb.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pint_qtb.mod' due to: pint_qtb.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_qtb.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod pint_types.mod input_section_types.mod base_hooks.mod fft_lib.mod cp_log_handling.mod input_constants.mod kinds.mod fft_tools.mod mathconstants.mod cp_output_handling.mod fft_plan.mod message_passing.mod cp_files.mod pint_io.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pint_gle.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_gle.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 gle_system_types.mod pint_types.mod base_hooks.mod kinds.mod gle_system_dynamics.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_gle.F pint_gle.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:44:33 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_gle.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_gle.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pint_gle.mod' due to: pint_gle.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_gle.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 gle_system_types.mod pint_types.mod base_hooks.mod kinds.mod gle_system_dynamics.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pint_piglet.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_piglet.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod parallel_rng_types.mod pint_types.mod base_hooks.mod kinds.mod gle_system_dynamics.mod message_passing.mod input_constants.mod cp_units.mod cp_files.mod pint_io.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_piglet.F pint_piglet.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:44:35 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_piglet.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_piglet.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pint_piglet.mod' due to: pint_piglet.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_piglet.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod parallel_rng_types.mod pint_types.mod base_hooks.mod kinds.mod gle_system_dynamics.mod message_passing.mod input_constants.mod cp_units.mod cp_files.mod pint_io.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'helium_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 helium_types.mod atomic_kind_types.mod cell_types.mod force_env_types.mod splines_types.mod pint_types.mod input_section_types.mod cp_subsys_types.mod parallel_rng_types.mod particle_list_types.mod pint_public.mod helium_interactions.mod helium_sampling.mod input_constants.mod kinds.mod f77_interface.mod helium_io.mod bibliography.mod splines_methods.mod cp_output_handling.mod base_hooks.mod mathconstants.mod physcon.mod cp_files.mod cp_log_handling.mod helium_common.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_methods.F helium_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:44:39 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/helium_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' helium_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_methods.F:439:16: 439 | IF (expl_pot) THEN | ^ Warning: ‘expl_pot’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'helium_methods.mod' due to: helium_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 helium_types.mod atomic_kind_types.mod cell_types.mod force_env_types.mod splines_types.mod pint_types.mod input_section_types.mod cp_subsys_types.mod parallel_rng_types.mod particle_list_types.mod pint_public.mod helium_interactions.mod helium_sampling.mod input_constants.mod kinds.mod f77_interface.mod helium_io.mod bibliography.mod splines_methods.mod cp_output_handling.mod base_hooks.mod mathconstants.mod physcon.mod cp_files.mod cp_log_handling.mod helium_common.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pint_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 helium_types.mod molecule_kind_list_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod global_types.mod force_env_types.mod gle_system_types.mod atomic_kind_list_types.mod pint_types.mod replica_types.mod particle_types.mod molecule_types.mod input_section_types.mod simpar_types.mod molecule_list_types.mod cp_subsys_types.mod cp_para_types.mod distribution_1d_types.mod parallel_rng_types.mod particle_list_types.mod replica_methods.mod pint_public.mod mathlib.mod helium_interactions.mod helium_sampling.mod pint_pile.mod input_constants.mod pint_qtb.mod pint_normalmode.mod cp_external_control.mod kinds.mod f77_interface.mod helium_io.mod bibliography.mod pint_transformations.mod cp_output_handling.mod input_cp2k_restarts.mod pint_gle.mod pint_io.mod base_hooks.mod constraint.mod mathconstants.mod pint_staging.mod machine.mod gle_system_dynamics.mod cp_units.mod cp_log_handling.mod pint_piglet.mod helium_methods.mod message_passing.mod constraint_util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_methods.F pint_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:44:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_methods.F:692:25: 692 | SUBROUTINE pint_retain(pint_env) | ^ Warning: ‘pint_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_methods.F:793:23: 793 | SUBROUTINE pint_test(para_env, input, input_declaration) | ^ Warning: ‘pint_test’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_methods.F:1202:89: 1202 | itmp, j, n_rep_val, nparticle, & | ^ Warning: ‘nparticle’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_methods.F:1902:82: 1902 | iresp, j, k, nparticle, nparticle_kind | ^ Warning: ‘nparticle’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_methods.F:2429:66: 2429 | pint_env%uv(1, j + (i - 1)*3) = vel(j, i)*factor | ^ Warning: ‘factor’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mode_selective.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mode_selective.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod replica_types.mod particle_types.mod input_section_types.mod global_types.mod replica_methods.mod base_hooks.mod cp_log_handling.mod input_constants.mod kinds.mod mathlib.mod util.mod physcon.mod cp_output_handling.mod message_passing.mod cp_files.mod molden_utils.mod cp_result_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mode_selective.F mode_selective.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:45:10 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mode_selective.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mode_selective.F90 /build/cp2k-Q381vr/cp2k-8.1/src/mode_selective.F:843:100: 843 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :) :: approx_H, H_save, residuum, tmp_b, tmp_s | ^ Warning: ‘tmp_s.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mode_selective.F:843:100: Warning: ‘tmp_s.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mode_selective.F:328:43: 328 | ms_vib%inv_range(1) = my_val | ^ Warning: ‘my_val’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mode_selective.F:276:66: 276 | REAL(KIND=dp) :: my_val, norm | ^ note: ‘my_val’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/mode_selective.F:120:67: 120 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: tmp_dip | ^ Warning: ‘tmp_dip.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mode_selective.F:120:67: Warning: ‘tmp_dip.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mode_selective.F:120:67: Warning: ‘tmp_dip.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/mode_selective.F:120:67: Warning: ‘tmp_dip.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mode_selective.mod' due to: mode_selective.o /build/cp2k-Q381vr/cp2k-8.1/src/mode_selective.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod replica_types.mod particle_types.mod input_section_types.mod global_types.mod replica_methods.mod base_hooks.mod cp_log_handling.mod input_constants.mod kinds.mod mathlib.mod util.mod physcon.mod cp_output_handling.mod message_passing.mod cp_files.mod molden_utils.mod cp_result_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'vibrational_analysis.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/vibrational_analysis.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod atomic_kind_types.mod molecule_kind_types.mod global_types.mod cp_fm_types.mod force_env_types.mod replica_types.mod particle_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod particle_list_types.mod replica_methods.mod mathlib.mod cp_fm_struct.mod header.mod input_constants.mod particle_methods.mod molden_utils.mod kinds.mod f77_interface.mod cp_blacs_env.mod grrm_utils.mod mode_selective.mod cp_output_handling.mod base_hooks.mod util.mod mathconstants.mod physcon.mod cp_log_handling.mod scine_utils.mod motion_utils.mod cp_result_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/vibrational_analysis.F vibrational_analysis.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:45:21 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/vibrational_analysis.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' vibrational_analysis.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/vibrational_analysis.F:124:72: 124 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: D, dip_deriv, RotTrM | ^ Warning: ‘dip_deriv.dim[1].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/vibrational_analysis.F:124:72: Warning: ‘dip_deriv.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/vibrational_analysis.F:125:67: 125 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: tmp_dip | ^ Warning: ‘tmp_dip.dim[2].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/vibrational_analysis.F:125:67: Warning: ‘tmp_dip.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/vibrational_analysis.F:125:67: Warning: ‘tmp_dip.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/vibrational_analysis.F:125:67: Warning: ‘tmp_dip.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/vibrational_analysis.F:125:67: Warning: ‘tmp_dip.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'bfgs_optimizer.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/bfgs_optimizer.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_f77_methods.f90 gopt_param_types.mod atomic_kind_types.mod cell_types.mod global_types.mod cp_fm_types.mod force_env_types.mod atomic_kind_list_types.mod gopt_f_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod particle_list_types.mod constraint_fxd.mod cp_fm_struct.mod cp_fm_diag.mod input_constants.mod cp_external_control.mod kinds.mod cp_blacs_env.mod cp_output_handling.mod base_hooks.mod machine.mod cp_fm_basic_linalg.mod cp_files.mod cp_gemm_interface.mod cp_log_handling.mod message_passing.mod gopt_f_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/bfgs_optimizer.F bfgs_optimizer.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:45:29 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/bfgs_optimizer.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' bfgs_optimizer.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'neb_md_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_md_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 neb_types.mod particle_types.mod input_section_types.mod global_types.mod base_hooks.mod kinds.mod input_constants.mod physcon.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_md_utils.F neb_md_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:45:36 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/neb_md_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' neb_md_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_md_utils.F:119:47: 119 | temp = 2.0_dp*akin/REAL(nvar, KIND=dp) | ^ Warning: ‘nvar’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'neb_md_utils.mod' due to: neb_md_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_md_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 neb_types.mod particle_types.mod input_section_types.mod global_types.mod base_hooks.mod kinds.mod input_constants.mod physcon.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_neb.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_neb.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod input_keyword_types.mod base_hooks.mod kinds.mod bibliography.mod input_cp2k_thermostats.mod cp_output_handling.mod string_utilities.mod input_constants.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_neb.F input_cp2k_neb.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:45:38 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_neb.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_neb.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_neb.mod' due to: input_cp2k_neb.o /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_neb.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod input_keyword_types.mod base_hooks.mod kinds.mod bibliography.mod input_cp2k_thermostats.mod cp_output_handling.mod string_utilities.mod input_constants.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'neb_io.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_io.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 neb_types.mod cell_types.mod force_env_types.mod replica_types.mod particle_types.mod input_enumeration_types.mod input_section_types.mod input_keyword_types.mod cp2k_info.mod header.mod input_constants.mod particle_methods.mod kinds.mod f77_interface.mod cp_output_handling.mod input_cp2k_restarts.mod base_hooks.mod neb_md_utils.mod physcon.mod input_cp2k_neb.mod machine.mod cp_files.mod cp_units.mod cp_log_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_io.F neb_io.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:45:39 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/neb_io.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' neb_io.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_io.F:426:55: 426 | logger%iter_info%project_name = replica_proj_name | 1 Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'md_run.mod' due to: md_run.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'bfgs_optimizer.mod' due to: bfgs_optimizer.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_lbfgs.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/cp_lbfgs.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod bibliography.mod machine.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/cp_lbfgs.F cp_lbfgs.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:45:43 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/cp_lbfgs.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_lbfgs.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/cp_lbfgs.F:1223:62: 1223 | tu, wmc, wmp, wmw, zibp | ^ Warning: ‘tu’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/cp_lbfgs.F:1308:38: 1308 | t(nbreak) = tl/(-neggi) | ^ Warning: ‘tl’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_lbfgs.mod' due to: cp_lbfgs.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/cp_lbfgs.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod bibliography.mod machine.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_lbfgs_optimizer_gopt.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/cp_lbfgs_optimizer_gopt.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_f77_methods.f90 force_env_types.mod cp_para_types.mod gopt_f_types.mod gopt_param_types.mod input_section_types.mod cp_para_env.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_lbfgs.mod machine.mod cp_output_handling.mod message_passing.mod gopt_f_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/cp_lbfgs_optimizer_gopt.F cp_lbfgs_optimizer_gopt.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:45:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/cp_lbfgs_optimizer_gopt.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_lbfgs_optimizer_gopt.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/cp_lbfgs_optimizer_gopt.F:302:32: 302 | SUBROUTINE cp_opt_gopt_retain(optimizer) | ^ Warning: ‘cp_opt_gopt_retain’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/motion/cp_lbfgs_optimizer_gopt.F:398:29: 398 | SUBROUTINE cp_opt_gopt_get(optimizer, para_env, & | ^ Warning: ‘cp_opt_gopt_get’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_lbfgs_optimizer_gopt.mod' due to: cp_lbfgs_optimizer_gopt.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/cp_lbfgs_optimizer_gopt.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_f77_methods.f90 force_env_types.mod cp_para_types.mod gopt_f_types.mod gopt_param_types.mod input_section_types.mod cp_para_env.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_lbfgs.mod machine.mod cp_output_handling.mod message_passing.mod gopt_f_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp_lbfgs_geo.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/cp_lbfgs_geo.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod cp_para_types.mod input_section_types.mod gopt_f_types.mod gopt_param_types.mod cell_types.mod global_types.mod cp_lbfgs_optimizer_gopt.mod cp_external_control.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_output_handling.mod input_constants.mod gopt_f_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/cp_lbfgs_geo.F cp_lbfgs_geo.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:45:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/cp_lbfgs_geo.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_lbfgs_geo.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_lbfgs_geo.mod' due to: cp_lbfgs_geo.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/cp_lbfgs_geo.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod cp_para_types.mod input_section_types.mod gopt_f_types.mod gopt_param_types.mod cell_types.mod global_types.mod cp_lbfgs_optimizer_gopt.mod cp_external_control.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_output_handling.mod input_constants.mod gopt_f_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'geo_opt.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/geo_opt.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod gopt_f_types.mod gopt_param_types.mod input_section_types.mod global_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cg_optimizer.mod cp_output_handling.mod gopt_f_methods.mod bfgs_optimizer.mod input_constants.mod cp_lbfgs_geo.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/geo_opt.F geo_opt.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:45:56 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/geo_opt.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' geo_opt.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'geo_opt.mod' due to: geo_opt.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/geo_opt.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod gopt_f_types.mod gopt_param_types.mod input_section_types.mod global_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cg_optimizer.mod cp_output_handling.mod gopt_f_methods.mod bfgs_optimizer.mod input_constants.mod cp_lbfgs_geo.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'neb_io.mod' due to: neb_io.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'neb_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 neb_types.mod global_types.mod force_env_types.mod cp_parser_types.mod replica_types.mod particle_types.mod input_section_types.mod cp_para_types.mod replica_methods.mod mathlib.mod input_constants.mod kinds.mod f77_interface.mod bibliography.mod input_cp2k_check.mod cp_output_handling.mod colvar_utils.mod md_run.mod base_hooks.mod neb_md_utils.mod geo_opt.mod physcon.mod rmsd.mod force_env_methods.mod neb_io.mod cp_log_handling.mod cp_parser_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_utils.F neb_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:45:58 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/neb_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' neb_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_utils.F:482:64: 482 | forces%wrk(:, SIZE(forces%wrk, 2)) = tmp_b ! Image B | ^ Warning: ‘tmp_b.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_utils.F:379:74: 379 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:) :: tangent, tmp_a, tmp_b | ^ Warning: ‘tmp_a.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'neb_utils.mod' due to: neb_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 neb_types.mod global_types.mod force_env_types.mod cp_parser_types.mod replica_types.mod particle_types.mod input_section_types.mod cp_para_types.mod replica_methods.mod mathlib.mod input_constants.mod kinds.mod f77_interface.mod bibliography.mod input_cp2k_check.mod cp_output_handling.mod colvar_utils.mod md_run.mod base_hooks.mod neb_md_utils.mod geo_opt.mod physcon.mod rmsd.mod force_env_methods.mod neb_io.mod cp_log_handling.mod cp_parser_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'neb_opt_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_opt_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 neb_types.mod replica_types.mod particle_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod neb_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_opt_utils.F neb_opt_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:46:08 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/neb_opt_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' neb_opt_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'dimer_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/dimer_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod force_env_types.mod gopt_f_types.mod dimer_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod dimer_utils.mod geo_opt.mod kinds.mod bibliography.mod cp_output_handling.mod motion_utils.mod input_constants.mod force_env_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/dimer_methods.F dimer_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:46:12 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/dimer_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dimer_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'neb_opt_utils.mod' due to: neb_opt_utils.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'neb_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 neb_types.mod global_types.mod force_env_types.mod replica_types.mod particle_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod replica_methods.mod header.mod input_constants.mod neb_opt_utils.mod cp_external_control.mod kinds.mod f77_interface.mod cp_output_handling.mod colvar_utils.mod base_hooks.mod neb_md_utils.mod physcon.mod neb_io.mod cp_log_handling.mod neb_utils.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_methods.F neb_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:46:15 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/neb_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' neb_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cell_opt.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/cell_opt.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod gopt_f_types.mod gopt_param_types.mod input_section_types.mod global_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cg_optimizer.mod cp_output_handling.mod gopt_f_methods.mod bfgs_optimizer.mod input_constants.mod cp_lbfgs_geo.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/cell_opt.F cell_opt.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:46:20 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/cell_opt.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cell_opt.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'dimer_methods.mod' due to: dimer_methods.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'gopt_f77_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_f77_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cell_types.mod force_env_types.mod virial_types.mod gopt_f_types.mod averages_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod particle_list_types.mod input_constants.mod particle_methods.mod kinds.mod bibliography.mod cell_opt_utils.mod md_run.mod base_hooks.mod geo_opt.mod dimer_methods.mod force_env_methods.mod cell_methods.mod cp_log_handling.mod message_passing.mod virial_methods.mod gopt_f_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/gopt_f77_methods.F gopt_f77_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:46:24 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/gopt_f77_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' gopt_f77_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_vib.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/input_cp2k_vib.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod cp_output_handling.mod string_utilities.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/input_cp2k_vib.F input_cp2k_vib.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:46:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/input_cp2k_vib.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_vib.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmotion.a' due to: helium_types.o dimer_utils.o reftraj_util.o md_run.o pint_public.o gopt_param_types.o dimer_types.o pint_methods.o gopt_f_types.o mdctrl_methods.o pint_io.o vibrational_analysis.o cell_opt_utils.o bfgs_optimizer.o helium_methods.o pint_normalmode.o cg_optimizer.o shell_opt.o neb_io.o simpar_methods.o md_ener_types.o neb_opt_utils.o cg_utils.o input_cp2k_md.o integrator_utils.o free_energy_methods.o dimer_methods.o md_conserved_quantities.o glbopt_callback.o neb_methods.o geo_opt.o pint_types.o helium_worm.o helium_common.o md_environment_types.o cell_opt.o velocity_verlet_control.o wiener_process.o neb_types.o md_energies.o gopt_f_methods.o gopt_f77_methods.o pint_transformations.o averages_types.o cell_opt_types.o helium_sampling.o neb_utils.o helium_io.o cp_lbfgs_geo.o md_util.o cp_lbfgs_optimizer_gopt.o cp_lbfgs.o reftraj_types.o rt_propagation.o pint_piglet.o thermal_region_utils.o pint_pile.o pint_staging.o neb_md_utils.o md_vel_utils.o pint_gle.o thermal_region_types.o input_cp2k_vib.o input_cp2k_restarts.o pint_qtb.o integrator.o helium_interactions.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmotion.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmotion.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmotion.a helium_types.o dimer_utils.o reftraj_util.o md_run.o pint_public.o gopt_param_types.o dimer_types.o pint_methods.o gopt_f_types.o mdctrl_methods.o pint_io.o vibrational_analysis.o cell_opt_utils.o bfgs_optimizer.o helium_methods.o pint_normalmode.o cg_optimizer.o shell_opt.o neb_io.o simpar_methods.o md_ener_types.o neb_opt_utils.o cg_utils.o input_cp2k_md.o integrator_utils.o free_energy_methods.o dimer_methods.o md_conserved_quantities.o glbopt_callback.o neb_methods.o geo_opt.o pint_types.o helium_worm.o helium_common.o md_environment_types.o cell_opt.o velocity_verlet_control.o wiener_process.o neb_types.o md_energies.o gopt_f_methods.o gopt_f77_methods.o pint_transformations.o averages_types.o cell_opt_types.o helium_sampling.o neb_utils.o helium_io.o cp_lbfgs_geo.o md_util.o cp_lbfgs_optimizer_gopt.o cp_lbfgs.o reftraj_types.o rt_propagation.o pint_piglet.o thermal_region_utils.o pint_pile.o pint_staging.o neb_md_utils.o md_vel_utils.o pint_gle.o thermal_region_types.o input_cp2k_vib.o input_cp2k_restarts.o pint_qtb.o integrator.o helium_interactions.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmotion.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kthermostat.a' due to: barostat_types.o thermostat_methods.o al_system_init.o csvr_system_dynamics.o thermostat_mapping.o extended_system_init.o gle_system_dynamics.o extended_system_mapping.o thermostat_types.o csvr_system_init.o input_cp2k_barostats.o extended_system_dynamics.o al_system_dynamics.o thermostat_utils.o csvr_system_mapping.o al_system_mapping.o barostat_utils.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kthermostat.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kthermostat.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kthermostat.a barostat_types.o thermostat_methods.o al_system_init.o csvr_system_dynamics.o thermostat_mapping.o extended_system_init.o gle_system_dynamics.o extended_system_mapping.o thermostat_types.o csvr_system_init.o input_cp2k_barostats.o extended_system_dynamics.o al_system_dynamics.o thermostat_utils.o csvr_system_mapping.o al_system_mapping.o barostat_utils.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kthermostat.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kemd.a' due to: rt_propagation_methods.o rt_propagator_init.o rt_delta_pulse.o rt_hfx_utils.o rt_make_propagators.o rt_propagation_output.o rt_propagation_utils.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kemd.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kemd.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kemd.a rt_propagation_methods.o rt_propagator_init.o rt_delta_pulse.o rt_hfx_utils.o rt_make_propagators.o rt_propagation_output.o rt_propagation_utils.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kemd.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp2k_debug.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/cp2k_debug.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod cell_types.mod force_env_types.mod cp_result_types.mod cp_control_types.mod virial_types.mod particle_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod qs_environment_types.mod input_constants.mod particle_methods.mod kinds.mod cp_output_handling.mod base_hooks.mod force_env_methods.mod cp_log_handling.mod cp_result_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/cp2k_debug.F cp2k_debug.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:46:30 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp2k_debug.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp2k_debug.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'negf_green_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/negf_green_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_cfm_basic_linalg.mod cp_fm_struct.mod mathconstants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/negf_green_methods.F negf_green_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:46:33 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_green_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_green_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_tddfpt_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod cp_fm_pool_types.mod cp_control_types.mod qs_p_env_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_fm_struct.mod qs_matrix_pools.mod cp_blacs_env.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt_types.F qs_tddfpt_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:46:34 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_tddfpt_types.mod' due to: qs_tddfpt_types.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod cp_fm_pool_types.mod cp_control_types.mod qs_p_env_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_fm_struct.mod qs_matrix_pools.mod cp_blacs_env.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_tddfpt_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_control_types.mod qs_mo_types.mod qs_p_env_types.mod qs_tddfpt_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod qs_p_env_methods.mod cp_fm_basic_linalg.mod cp_dbcsr_operations.mod cp_fm_cholesky.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt_utils.F qs_tddfpt_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:46:35 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_tddfpt_utils.mod' due to: qs_tddfpt_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_control_types.mod qs_mo_types.mod qs_p_env_types.mod qs_tddfpt_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod qs_p_env_methods.mod cp_fm_basic_linalg.mod cp_dbcsr_operations.mod cp_fm_cholesky.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_tddfpt_eigensolver.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt_eigensolver.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_p_env_types.mod cp_fm_types.mod cp_control_types.mod cp_fm_pool_types.mod qs_tddfpt_types.mod cp_para_types.mod qs_environment_types.mod cp_fm_struct.mod qs_matrix_pools.mod cp_fm_diag.mod input_constants.mod kinds.mod cp_blacs_env.mod qs_tddfpt_utils.mod base_hooks.mod physcon.mod qs_p_env_methods.mod cp_fm_basic_linalg.mod cp_log_handling.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt_eigensolver.F qs_tddfpt_eigensolver.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:46:38 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt_eigensolver.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt_eigensolver.F90 /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt_eigensolver.F:447:13: 447 | IF (mode == 'L') THEN | ^ Warning: ‘mode[1]{lb: 1 sz: 1}’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'farming_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/farming_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/farming_types.F farming_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:46:43 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"farming_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' farming_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'negf_alloc_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/negf_alloc_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/negf_alloc_types.F negf_alloc_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:46:43 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_alloc_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_alloc_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'optimize_basis_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/optimize_basis_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod powell.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/optimize_basis_types.F optimize_basis_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:46:44 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"optimize_basis_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' optimize_basis_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'optimize_basis_types.mod' due to: optimize_basis_types.o /build/cp2k-Q381vr/cp2k-8.1/src/optimize_basis_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod powell.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'optimize_basis_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/optimize_basis_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod optimize_basis_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod cp_log_handling.mod input_constants.mod cp_parser_methods.mod kinds.mod machine.mod string_utilities.mod cp_files.mod powell.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/optimize_basis_utils.F optimize_basis_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:46:47 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"optimize_basis_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' optimize_basis_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'optbas_opt_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/optbas_opt_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_mo_types.mod cp_fm_types.mod base_hooks.mod kinds.mod cp_fm_diag.mod cp_fm_basic_linalg.mod cp_dbcsr_operations.mod cp_gemm_interface.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/optbas_opt_utils.F optbas_opt_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:46:53 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"optbas_opt_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' optbas_opt_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_optimize_input.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_optimize_input.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_val_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod cp_output_handling.mod string_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_optimize_input.F input_optimize_input.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:46:54 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_optimize_input.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_optimize_input.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mao_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mao_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mao_types.F mao_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:46:55 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mao_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mao_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/mao_types.F:38:29: 38 | SUBROUTINE create_mao_type(mao_env) | ^ Warning: ‘create_mao_type’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'semi_empirical_int_debug.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_debug.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod base_hooks.mod kinds.mod semi_empirical_int_num.mod semi_empirical_int_utils.mod semi_empirical_int_arrays.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_debug.F semi_empirical_int_debug.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:46:55 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_int_debug.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_int_debug.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'negf_alloc_types.mod' due to: negf_alloc_types.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'negf_control_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/negf_control_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod negf_alloc_types.mod particle_types.mod molecule_types.mod molecule_kind_types.mod input_section_types.mod base_hooks.mod kinds.mod util.mod mathconstants.mod physcon.mod string_utilities.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/negf_control_types.F negf_control_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:46:57 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_control_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_control_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'negf_control_types.mod' due to: negf_control_types.o /build/cp2k-Q381vr/cp2k-8.1/src/negf_control_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod negf_alloc_types.mod particle_types.mod molecule_types.mod molecule_kind_types.mod input_section_types.mod base_hooks.mod kinds.mod util.mod mathconstants.mod physcon.mod string_utilities.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'negf_subgroup_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/negf_subgroup_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod negf_control_types.mod cp_para_env.mod base_hooks.mod cp_blacs_env.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/negf_subgroup_types.F negf_subgroup_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:47:00 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_subgroup_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_subgroup_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'negf_subgroup_types.mod' due to: negf_subgroup_types.o /build/cp2k-Q381vr/cp2k-8.1/src/negf_subgroup_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod negf_control_types.mod cp_para_env.mod base_hooks.mod cp_blacs_env.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'negf_atom_map.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/negf_atom_map.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_subsys_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/negf_atom_map.F negf_atom_map.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:47:01 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_atom_map.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_atom_map.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'negf_atom_map.mod' due to: negf_atom_map.o /build/cp2k-Q381vr/cp2k-8.1/src/negf_atom_map.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_subsys_types.mod particle_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'negf_matrix_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/negf_matrix_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod negf_alloc_types.mod qs_subsys_types.mod particle_types.mod qs_kind_types.mod cp_fm_types.mod base_hooks.mod kinds.mod negf_atom_map.mod cp_fm_basic_linalg.mod message_passing.mod particle_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/negf_matrix_utils.F negf_matrix_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:47:02 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_matrix_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_matrix_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'negf_matrix_utils.mod' due to: negf_matrix_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/negf_matrix_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod negf_alloc_types.mod qs_subsys_types.mod particle_types.mod qs_kind_types.mod cp_fm_types.mod base_hooks.mod kinds.mod negf_atom_map.mod cp_fm_basic_linalg.mod message_passing.mod particle_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'negf_vectors.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/negf_vectors.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod qs_subsys_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/negf_vectors.F negf_vectors.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:47:06 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_vectors.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_vectors.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'negf_vectors.mod' due to: negf_vectors.o /build/cp2k-Q381vr/cp2k-8.1/src/negf_vectors.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod qs_subsys_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'negf_env_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/negf_env_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cell_types.mod negf_subgroup_types.mod pw_types.mod cp_fm_types.mod force_env_types.mod cp_control_types.mod kpoint_types.mod qs_rho_types.mod qs_subsys_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod qs_density_mixing_types.mod pw_pool_types.mod pw_env_types.mod negf_control_types.mod cp_fm_struct.mod negf_matrix_utils.mod qs_energy.mod qs_integrate_potential.mod kinds.mod cp_blacs_env.mod base_hooks.mod negf_atom_map.mod negf_vectors.mod qs_energy_init.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/negf_env_types.F negf_env_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:47:06 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_env_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_env_types.F90 /build/cp2k-Q381vr/cp2k-8.1/src/negf_env_types.F:1051:13: 1051 | IF (imo == 0) THEN | ^ Warning: ‘imo’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/negf_env_types.F:995:93: 995 | INTEGER :: handle, homo, ikpgr, ikpoint, imo, & | ^ note: ‘imo’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cg_test.mod' due to: cg_test.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'shg_integrals_test.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/shg_integrals_test.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod input_val_types.mod input_keyword_types.mod input_section_types.mod input_cp2k_subsys.mod base_hooks.mod cp_log_handling.mod kinds.mod constants_operator.mod orbital_transformation_matrices.mod generic_os_integrals.mod generic_shg_integrals.mod orbital_pointers.mod generic_shg_integrals_init.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/shg_integrals_test.F shg_integrals_test.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:47:14 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"shg_integrals_test.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' shg_integrals_test.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'shg_integrals_test.mod' due to: shg_integrals_test.o /build/cp2k-Q381vr/cp2k-8.1/src/shg_integrals_test.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod input_val_types.mod input_keyword_types.mod input_section_types.mod input_cp2k_subsys.mod base_hooks.mod cp_log_handling.mod kinds.mod constants_operator.mod orbital_transformation_matrices.mod generic_os_integrals.mod generic_shg_integrals.mod orbital_pointers.mod generic_shg_integrals_init.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ai_coulomb_test.mod' due to: ai_coulomb_test.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'library_tests.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/library_tests.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod cell_types.mod global_types.mod pw_types.mod cp_fm_types.mod realspace_grid_types.mod input_section_types.mod cp_para_types.mod parallel_rng_types.mod cp_fm_struct.mod cp_fm_diag.mod mp2_grids.mod pw_methods.mod input_constants.mod cg_test.mod kinds.mod minimax_exp.mod cp_blacs_env.mod cp_output_handling.mod shg_integrals_test.mod base_hooks.mod fft_tools.mod machine.mod cp_fm_basic_linalg.mod cp_files.mod ai_coulomb_test.mod cp_gemm_interface.mod cp_log_handling.mod cp_eri_mme_interface.mod message_passing.mod cp_realspace_grid_init.mod pw_grids.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/library_tests.F library_tests.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:47:18 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"library_tests.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' library_tests.F90 /build/cp2k-Q381vr/cp2k-8.1/src/library_tests.F:925:21: 925 | ELSE IF (is_fullspace) THEN | ^ Warning: ‘is_fullspace’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'optbas_fenv_manipulation.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/optbas_fenv_manipulation.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_kind_types.mod qs_ks_types.mod atomic_kind_types.mod cp_fm_types.mod basis_set_types.mod basis_set_container_types.mod optimize_basis_types.mod cp_control_types.mod cp_fm_pool_types.mod qs_rho_types.mod particle_types.mod qs_mo_types.mod input_section_types.mod scf_control_types.mod cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_fm_struct.mod qs_matrix_pools.mod string_utilities.mod qs_mo_methods.mod input_constants.mod qs_mo_io.mod kinds.mod cp_blacs_env.mod cp_output_handling.mod qs_rho_methods.mod base_hooks.mod qs_overlap.mod qs_interactions.mod cp_fm_basic_linalg.mod cp_fm_cholesky.mod cp_log_handling.mod qs_ks_methods.mod qs_energy_init.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/optbas_fenv_manipulation.F optbas_fenv_manipulation.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:47:24 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"optbas_fenv_manipulation.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' optbas_fenv_manipulation.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'optimize_basis_utils.mod' due to: optimize_basis_utils.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'optbas_opt_utils.mod' due to: optbas_opt_utils.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'optbas_fenv_manipulation.mod' due to: optbas_fenv_manipulation.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'optimize_basis.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/optimize_basis.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod cp_fm_types.mod force_env_types.mod optimize_basis_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod optimize_basis_utils.mod kinds.mod f77_interface.mod cp_blacs_env.mod optbas_opt_utils.mod powell.mod optbas_fenv_manipulation.mod cp_para_env.mod base_hooks.mod admm_methods.mod input_cp2k_read.mod machine.mod cp_log_handling.mod message_passing.mod qs_neighbor_lists.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/optimize_basis.F optimize_basis.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:47:28 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"optimize_basis.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' optimize_basis.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'negf_integr_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/negf_integr_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/negf_integr_utils.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/negf_integr_utils.F negf_integr_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:47:35 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_integr_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_integr_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/src/negf_integr_utils.F:181:3: 181 | PURE FUNCTION get_axis_rotation_angle(a, b) RESULT(phi) | ^ Warning: ‘get_axis_rotation_angle’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'negf_integr_utils.mod' due to: negf_integr_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/negf_integr_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/negf_integr_utils.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'negf_integr_cc.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/negf_integr_cc.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_fm_types.mod base_hooks.mod kinds.mod negf_integr_utils.mod cp_cfm_basic_linalg.mod kahan_sum.mod cp_fm_struct.mod fft_tools.mod mathconstants.mod cp_fm_basic_linalg.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/negf_integr_cc.F negf_integr_cc.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:47:36 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_integr_cc.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_integr_cc.F90 /build/cp2k-Q381vr/cp2k-8.1/src/negf_integr_cc.F:400:51: 400 | ALLOCATE (cc_env%zdata_cache(nnodes_half)) | ^ Warning: ‘nnodes_half’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/negf_integr_cc.F:273:41: 273 | ALLOCATE (xnodes_next(nnodes_next)) | ^ Warning: ‘nnodes_next’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'atom_pseudo.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/atom_pseudo.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod base_hooks.mod cp_log_handling.mod kinds.mod atom_electronic_structure.mod physcon.mod atom_fit.mod atom_operators.mod atom_output.mod atom_utils.mod cp_output_handling.mod input_constants.mod periodic_table.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/atom_pseudo.F atom_pseudo.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:47:38 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_pseudo.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_pseudo.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'atom_pseudo.mod' due to: atom_pseudo.o /build/cp2k-Q381vr/cp2k-8.1/src/atom_pseudo.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod base_hooks.mod cp_log_handling.mod kinds.mod atom_electronic_structure.mod physcon.mod atom_fit.mod atom_operators.mod atom_output.mod atom_utils.mod cp_output_handling.mod input_constants.mod periodic_table.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'atom_grb.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/atom_grb.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod base_hooks.mod kinds.mod input_constants.mod atom_electronic_structure.mod mathconstants.mod lapack.mod atom_operators.mod orbital_transformation_matrices.mod physcon.mod atom_utils.mod ai_onecenter.mod powell.mod orbital_pointers.mod cp_files.mod periodic_table.mod qs_grid_atom.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/atom_grb.F atom_grb.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:47:41 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_grb.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_grb.F90 /build/cp2k-Q381vr/cp2k-8.1/src/atom_grb.F:763:23: 763 | nval = lmax | ^ Warning: ‘lmax’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/atom_grb.F:765:69: 765 | WRITE (iunit, "(40I3)") nval, lmin, lmax, nprim, (nbas(l), l=lmin, lmax) | ^ Warning: ‘lmin’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/atom_grb.F:763:23: 763 | nval = lmax | ^ Warning: ‘lmax’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/atom_grb.F:765:69: 765 | WRITE (iunit, "(40I3)") nval, lmin, lmax, nprim, (nbas(l), l=lmin, lmax) | ^ Warning: ‘lmin’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/atom_grb.F:763:23: 763 | nval = lmax | ^ Warning: ‘lmax’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/atom_grb.F:765:69: 765 | WRITE (iunit, "(40I3)") nval, lmin, lmax, nprim, (nbas(l), l=lmin, lmax) | ^ Warning: ‘lmin’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/atom_grb.F:265:54: 265 | state%occupation(lhomo, nhomo) = fhomo + dene | ^ Warning: ‘fhomo’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'atom_grb.mod' due to: atom_grb.o /build/cp2k-Q381vr/cp2k-8.1/src/atom_grb.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod base_hooks.mod kinds.mod input_constants.mod atom_electronic_structure.mod mathconstants.mod lapack.mod atom_operators.mod orbital_transformation_matrices.mod physcon.mod atom_utils.mod ai_onecenter.mod powell.mod orbital_pointers.mod cp_files.mod periodic_table.mod qs_grid_atom.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'atom_admm_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/atom_admm_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod base_hooks.mod kinds.mod mathlib.mod atom_xc.mod atom_operators.mod atom_output.mod atom_utils.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/atom_admm_methods.F atom_admm_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:47:55 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_admm_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_admm_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/atom_admm_methods.F:213:19: 213 | IF (rhf) THEN | ^ Warning: ‘rhf’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'atom_admm_methods.mod' due to: atom_admm_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/atom_admm_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod base_hooks.mod kinds.mod mathlib.mod atom_xc.mod atom_operators.mod atom_output.mod atom_utils.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'atom_energy.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/atom_energy.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atom_types.mod input_section_types.mod atom_xc.mod atom_grb.mod atom_utils.mod input_constants.mod kinds.mod atom_fit.mod atom_operators.mod cp_output_handling.mod periodic_table.mod atom_sgp.mod base_hooks.mod atom_electronic_structure.mod mathconstants.mod physcon.mod atom_admm_methods.mod cp_log_handling.mod atom_output.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/atom_energy.F atom_energy.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:48:06 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_energy.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_energy.F90 /build/cp2k-Q381vr/cp2k-8.1/src/atom_energy.F:530:54: 530 | state%occupation(lhomo, nhomo) = fhomo + dene | ^ Warning: ‘fhomo’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/atom_energy.F:492:85: 492 | REAL(KIND=dp) :: dene, emax, expzet, fhomo, o, prefac, & | ^ note: ‘fhomo’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'atom_energy.mod' due to: atom_energy.o /build/cp2k-Q381vr/cp2k-8.1/src/atom_energy.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atom_types.mod input_section_types.mod atom_xc.mod atom_grb.mod atom_utils.mod input_constants.mod kinds.mod atom_fit.mod atom_operators.mod cp_output_handling.mod periodic_table.mod atom_sgp.mod base_hooks.mod atom_electronic_structure.mod mathconstants.mod physcon.mod atom_admm_methods.mod cp_log_handling.mod atom_output.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'atom_basis.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/atom_basis.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod base_hooks.mod cp_log_handling.mod kinds.mod atom_fit.mod atom_output.mod atom_utils.mod cp_output_handling.mod input_constants.mod periodic_table.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/atom_basis.F atom_basis.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:48:15 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_basis.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_basis.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'atom_basis.mod' due to: atom_basis.o /build/cp2k-Q381vr/cp2k-8.1/src/atom_basis.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod base_hooks.mod cp_log_handling.mod kinds.mod atom_fit.mod atom_output.mod atom_utils.mod cp_output_handling.mod input_constants.mod periodic_table.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'atom.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/atom.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod atom_pseudo.mod cp_output_handling.mod atom_energy.mod atom_basis.mod header.mod input_constants.mod periodic_table.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/atom.F atom.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:48:17 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_negf.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_negf.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod qs_density_mixing_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod kinds.mod physcon.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_negf.F input_cp2k_negf.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:48:18 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_negf.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_negf.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'bsse.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/bsse.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cell_types.mod global_types.mod force_env_types.mod qs_energy_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod qs_environment_types.mod particle_list_types.mod cp2k_info.mod string_utilities.mod input_constants.mod qs_environment.mod qs_energy.mod cp_external_control.mod kinds.mod cp_subsys_methods.mod cp_output_handling.mod base_hooks.mod cp_log_handling.mod memory_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/bsse.F bsse.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:48:19 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"bsse.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' bsse.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'negf_env_types.mod' due to: negf_env_types.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'negf_integr_simpson.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/negf_integr_simpson.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_fm_types.mod base_hooks.mod kinds.mod negf_integr_utils.mod cp_cfm_basic_linalg.mod util.mod cp_fm_struct.mod mathconstants.mod cp_fm_basic_linalg.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/negf_integr_simpson.F negf_integr_simpson.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:48:24 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_integr_simpson.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_integr_simpson.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'negf_integr_simpson.mod' due to: negf_integr_simpson.o /build/cp2k-Q381vr/cp2k-8.1/src/negf_integr_simpson.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_fm_types.mod base_hooks.mod kinds.mod negf_integr_utils.mod cp_cfm_basic_linalg.mod util.mod cp_fm_struct.mod mathconstants.mod cp_fm_basic_linalg.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'negf_green_cache.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/negf_green_cache.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod base_hooks.mod kinds.mod util.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/negf_green_cache.F negf_green_cache.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:48:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_green_cache.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_green_cache.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'negf_green_cache.mod' due to: negf_green_cache.o /build/cp2k-Q381vr/cp2k-8.1/src/negf_green_cache.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod base_hooks.mod kinds.mod util.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'negf_green_methods.mod' due to: negf_green_methods.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'negf_integr_cc.mod' due to: negf_integr_cc.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'negf_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/negf_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 negf_env_types.mod negf_subgroup_types.mod global_types.mod cp_fm_types.mod force_env_types.mod cp_control_types.mod kpoint_types.mod qs_rho_types.mod qs_subsys_types.mod cp_cfm_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod qs_environment_types.mod qs_density_mixing_types.mod negf_control_types.mod negf_integr_simpson.mod cp_fm_struct.mod string_utilities.mod input_constants.mod negf_green_cache.mod negf_matrix_utils.mod kinds.mod cp_blacs_env.mod bibliography.mod cp_output_handling.mod qs_rho_methods.mod cp_cfm_basic_linalg.mod base_hooks.mod negf_green_methods.mod mathconstants.mod physcon.mod machine.mod cp_fm_basic_linalg.mod cp_log_handling.mod qs_ks_methods.mod qs_gspace_mixing.mod qs_mixing_utils.mod qs_scf_methods.mod message_passing.mod cp_dbcsr_operations.mod negf_integr_cc.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/negf_methods.F negf_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:48:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/src/negf_methods.F:1409:80: 1409 | TYPE(cp_cfm_p_type), ALLOCATABLE, DIMENSION(:, :) :: gamma_contacts_group, & | ^ Warning: ‘gamma_contacts_group.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/negf_methods.F:1409:80: Warning: ‘gamma_contacts_group.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/negf_methods.F:1410:81: 1410 | gret_gamma_gadv_group | ^ Warning: ‘gret_gamma_gadv_group.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/negf_methods.F:1410:81: Warning: ‘gret_gamma_gadv_group.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/negf_methods.F:2789:84: 2789 | INTEGER :: handle, icontact, ipoint, ispin, & | ^ Warning: ‘ipoint’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/negf_methods.F:3000:73: 3000 | xnodes(ipoint) = CMPLX(energy_min, negf_control%eta, kind=dp) | ^ Warning: ‘ipoint’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/negf_methods.F:2946:84: 2946 | INTEGER :: handle, icontact, ipoint, ispin, & | ^ note: ‘ipoint’ was declared here /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_constraints.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_constraints.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod cell_types.mod base_hooks.mod kinds.mod input_constants.mod cp_output_handling.mod string_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_constraints.F input_cp2k_constraints.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:48:39 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_constraints.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_constraints.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'optimize_input.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/optimize_input.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cell_types.mod cp_parser_types.mod input_section_types.mod cp_para_types.mod parallel_rng_types.mod cp2k_info.mod input_constants.mod cp_external_control.mod kinds.mod f77_interface.mod cp_output_handling.mod powell.mod base_hooks.mod environment.mod physcon.mod machine.mod cp_log_handling.mod memory_utilities.mod message_passing.mod cp_parser_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/optimize_input.F optimize_input.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:48:40 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"optimize_input.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' optimize_input.F90 /build/cp2k-Q381vr/cp2k-8.1/src/optimize_input.F:182:69: 182 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: cell_traj, cell_traj_read, force_traj, & | ^ Warning: ‘cell_traj.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mscfg_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/mscfg_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 almo_scf_types.mod atomic_kind_types.mod cell_types.mod global_types.mod force_env_types.mod qs_energy_types.mod mscfg_types.mod qs_mo_types.mod molecule_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod qs_environment_types.mod particle_list_types.mod input_constants.mod qs_environment.mod qs_energy.mod kinds.mod cp_subsys_methods.mod base_hooks.mod cp_log_handling.mod cp_dbcsr_operations.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/mscfg_methods.F mscfg_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:48:45 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mscfg_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mscfg_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'pilaenv_hack.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/pilaenv_hack.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/pilaenv_hack.F pilaenv_hack.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:48:49 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pilaenv_hack.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pilaenv_hack.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'farming_types.mod' due to: farming_types.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'farming_methods.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/farming_methods.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod farming_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod cp_output_handling.mod message_passing.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/farming_methods.F farming_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:48:49 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"farming_methods.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' farming_methods.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'ipi_driver.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/ipi_driver.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cp_para_types.mod force_env_types.mod virial_types.mod input_section_types.mod cell_types.mod global_types.mod base_hooks.mod cp_external_control.mod cp_log_handling.mod kinds.mod bibliography.mod message_passing.mod force_env_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/ipi_driver.F ipi_driver.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:48:50 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ipi_driver.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ipi_driver.F90 /build/cp2k-Q381vr/cp2k-8.1/src/ipi_driver.F:209:26: 209 | SUBROUTINE readbuffer_d(psockfd, fdata) | ^ Warning: ‘readbuffer_d’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_tddfpt_eigensolver.mod' due to: qs_tddfpt_eigensolver.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'qs_tddfpt_module.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt_module.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_ks_types.mod qs_p_env_types.mod qs_energy_types.mod qs_rho_types.mod input_section_types.mod qs_tddfpt_types.mod qs_environment_types.mod header.mod input_constants.mod bibliography.mod cp_output_handling.mod qs_tddfpt_utils.mod qs_tddfpt_eigensolver.mod base_hooks.mod xc_pot_saop.mod cp_log_handling.mod qs_ks_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/qs_tddfpt_module.F qs_tddfpt_module.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:48:52 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt_module.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt_module.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_atom.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_atom.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_output_handling.mod string_utilities.mod input_constants.mod input_cp2k_xc.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_cp2k_atom.F input_cp2k_atom.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:48:55 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_atom.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_atom.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_optimize_basis.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/input_optimize_basis.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_val_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod string_utilities.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/input_optimize_basis.F input_optimize_basis.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:48:57 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_optimize_basis.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_optimize_basis.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'sockets.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/sockets.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/sockets.c /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmain.a' due to: lri_ks_methods.o kg_environment_types.o semi_empirical_int_utils.o grrm_utils.o input_cp2k_eip.o qs_diis_types.o qs_scf_initialization.o ewald_methods_tb.o hfx_pair_list_methods.o qs_fb_distribution_methods.o qs_scf_post_scf.o qs_core_energies.o manybody_tersoff.o mao_basis.o qmmm_gaussian_data.o qs_ot_types.o qs_sccs.o qs_update_s_mstruct.o qs_fb_atomic_halo_types.o qs_rho0_types.o preconditioner_apply.o fist_efield_methods.o qs_efield_local.o iterate_matrix.o core_ppnl.o dm_ls_scf_create.o constraint_vsite.o qs_rho_atom_types.o qs_rho_methods.o kpoint_io.o qs_loc_types.o qs_energy_init.o almo_scf_env_methods.o pao_potentials.o submatrix_types.o input_cp2k_free_energy.o cp_external_control.o qs_ks_apply_restraints.o xas_tdp_correction.o xas_tdp_utils.o pexsi_interface.o pair_potential_types.o qs_ks_qmmm_types.o semi_empirical_mpole_types.o qs_grid_atom.o qs_dftb_utils.o qs_efield_berry.o qs_linres_issc_utils.o mp2.o taper_types.o cp2k_debug.o qs_kpp1_env_types.o pao_ml_gaussprocess.o input_cp2k_ec.o qs_ot.o qs_electric_field_gradient.o negf_green_methods.o qs_tddfpt_eigensolver.o stm_images.o preconditioner.o qmmm_gpw_forces.o lri_optimize_ri_basis.o ec_efield_local.o force_env_utils.o qs_tddfpt2_densities.o farming_types.o maxwell_solver_interface.o xtb_parameters.o qs_environment_methods.o se_fock_matrix_dbg.o topology.o topology_gromos.o manybody_eam.o cp_realspace_grid_init.o qs_linres_module.o qs_gcp_utils.o semi_empirical_int_arrays.o xtb_types.o negf_alloc_types.o qs_o3c_methods.o rmsd.o hartree_local_types.o preconditioner_types.o semi_empirical_int_ana.o mixed_cdft_types.o qs_ks_atom.o input_cp2k_mm.o fp_types.o qs_ot_eigensolver.o auto_basis.o optimize_basis_utils.o ec_environment.o constraint_4x6.o hirshfeld_methods.o pao_ml_descriptor.o rt_propagation_types.o semi_empirical_int_num.o subcell_types.o qs_rho0_methods.o dm_ls_scf_curvy.o lri_compression.o fist_neighbor_lists.o bse.o qs_scf_block_davidson.o molden_utils.o atom_xc.o replica_methods.o optbas_opt_utils.o lri_integrals.o motion_utils.o nnp_model.o libint_wrapper.o input_optimize_input.o qs_dispersion_types.o cp_control_types.o mp2_optimize_ri_basis.o ewald_environment_types.o se_fock_matrix_exchange.o qs_kinetic.o pw_env_methods.o qs_scf_loop_utils.o ewald_pw_methods.o fist_neighbor_list_control.o atom_utils.o input_cp2k_global.o dft_plus_u.o molsym.o response_solver.o mao_types.o external_potential_methods.o rpa_kpoints.o virial_methods.o qs_fb_hash_table_types.o qs_dispersion_pairpot.o xas_tp_scf.o atom_optimization.o input_cp2k_colvar.o qmmmx_types.o cp_ddapc_types.o cell_methods.o qs_nl_hash_table_types.o qs_mo_methods.o qs_mo_io.o matrix_exp.o mixed_cdft_utils.o almo_scf_lbfgs_types.o qs_subsys_methods.o ewald_pw_types.o semi_empirical_int_debug.o qs_integrate_potential.o semi_empirical_parameters.o input_cp2k_atprop.o negf_env_types.o pair_potential.o transport_env_types.o library_tests.o optbas_fenv_manipulation.o qmmm_per_elpot.o xas_tdp_atom.o cp_eri_mme_interface.o qs_fb_env_methods.o xas_restart.o qs_linres_types.o input_cp2k_dft.o replica_types.o mp2_ri_grad.o cryssym.o qs_linres_nmr_epr_common_utils.o almo_scf_diis_types.o pwdft_environment.o pao_param.o splines_methods.o metadynamics_types.o qs_o3c_types.o simpar_types.o qs_diis.o qs_ks_types.o qs_gspace_mixing.o admm_types.o block_p_types.o topology_generate_util.o spglib_f08.o qmmm_gpw_energy.o qmmm_gaussian_types.o mao_optimizer.o negf_control_types.o qs_force_types.o qmmm_gaussian_input.o qmmm_types_low.o mm_collocate_potential.o optimize_basis.o molecular_states.o negf_integr_cc.o fist_force.o force_fields_ext.o atom.o minbas_methods.o almo_scf_qs.o manybody_gal.o pao_input.o input_constants.o mm_mapping_library.o pao_ml_neuralnet.o mp2_ri_gpw.o atom_upf.o qs_ks_utils.o qs_gapw_densities.o qs_ot_scf.o et_coupling.o force_fields_input.o se_fock_matrix_coulomb.o input_cp2k_negf.o qs_fb_com_tasks_types.o kg_correction.o pme.o input_cp2k_pwdft.o qs_integrate_potential_product.o qs_overlap.o hfx_communication.o se_core_core.o qs_dftb_coulomb.o topology_connectivity_util.o bsse.o qs_density_mixing_types.o kpoint_coulomb_2c.o qmmm_image_charge.o dm_ls_chebyshev.o qs_linres_current_utils.o qs_localization_methods.o optimize_embedding_potential.o beta_gamma_psi.o topology_coordinate_util.o semi_empirical_int3_utils.o qs_tddfpt2_operators.o input_cp2k_subsys.o input_restart_force_eval.o qs_p_env_types.o rpa_rse.o lri_optimize_ri_basis_types.o qs_condnum.o qs_linres_nmr_shift.o input_cp2k_tb.o force_env_methods.o atom_admm_methods.o input_restart_rng.o input_cp2k_hfx.o kg_environment.o qs_tddfpt2_eigensolver.o semi_empirical_expns3_methods.o pao_io.o lri_environment_methods.o extended_system_types.o environment.o qs_active_space_types.o task_list_methods.o qs_fb_input.o negf_methods.o submatrix_dissection.o lri_environment_init.o qs_dos.o qs_period_efield_types.o shg_integrals_test.o qs_ks_methods.o distribution_2d_types.o wannier_states_types.o qs_collocate_density.o qs_fb_trial_fns_types.o qs_dispersion_utils.o pwdft_environment_types.o qs_dftb_types.o qs_vxc.o qs_outer_scf.o qs_scf_post_se.o eip_environment_types.o atom_electronic_structure.o qs_wf_history_methods.o mode_selective.o mp2_ri_grad_util.o mp2_ri_2c.o topology_xtl.o mixed_energy_types.o ewalds_multipole.o qs_loc_states.o qs_integral_utils.o qs_energy_window.o mp2_gpw.o efield_tb_methods.o qs_mom_types.o negf_vectors.o constraint_fxd.o qs_linres_epr_utils.o qs_tddfpt2_methods.o qs_dftb3_methods.o pair_potential_coulomb.o rel_control_types.o surface_dipole.o qs_loc_utils.o topology_pdb.o input_cp2k_constraints.o pao_types.o fist_environment_types.o hfx_derivatives.o rpa_im_time.o constraint_clv.o qs_core_hamiltonian.o input_cp2k_kpoints.o hfx_compression_methods.o qs_external_potential.o domain_submatrix_types.o topology_psf.o input_cp2k_field.o atom_sgp.o pair_potential_util.o mp2_integrals.o qs_loc_dipole.o qs_resp.o mulliken.o constraint_util.o voronoi_interface.o cp_dbcsr_cp2k_link.o exclusion_types.o negf_atom_map.o input_cp2k_force_eval.o force_fields_all.o negf_integr_simpson.o cp_gemm_interface.o input_cp2k_xc.o fermi_utils.o pao_linpot_full.o constraint.o constraint_3x3.o fist_main.o input_cp2k_properties_dft.o qs_tddfpt2_properties.o rpa_communication.o qmmmx_update.o qs_cdft_scf_utils.o qmmmx_util.o optimize_input.o qs_gcp_method.o ewalds.o fist_pol_scf.o qs_commutators.o core_ppl.o qs_scf_wfn_mix.o hfx_admm_utils.o topology_cif.o mp2_gpw_method.o cp_ddapc_methods.o integration_grid_types.o mao_wfn_analysis.o qs_gamma2kp.o atom_basis.o negf_matrix_utils.o qs_environment_types.o dkh_main.o scf_control_types.o qs_moments.o mp2_ri_libint.o domain_submatrix_methods.o qs_cdft_types.o qs_cdft_methods.o ct_types.o qs_scf_methods.o embed_environment.o qs_mixing_utils.o colvar_methods.o xas_env_types.o outer_scf_control_types.o nnp_acsf.o xas_tdp_kernel.o eip_environment.o embed_main.o negf_integr_utils.o input_cp2k_mixed.o molecular_dipoles.o basis_set_output.o qs_rho_types.o kpoint_transitional.o qs_fb_env_types.o qs_scf_post_tb.o cp_realspace_grid_cube.o qs_gcp_types.o admm_utils.o lri_forces.o rpa_gw_kpoints.o gle_system_types.o semi_empirical_mpole_methods.o cp_symmetry.o qs_fb_atomic_matrix_methods.o pao_param_linpot.o input_cp2k_transport.o kg_tnadd_mat.o se_fock_matrix_integrals.o xas_tdp_types.o manybody_potential.o fist_energy_types.o qs_mo_types.o qs_cdft_utils.o qmmm_init.o semi_empirical_integrals.o cp_dbcsr_diag.o task_list_types.o qs_linres_epr_nablavks.o cp_control_utils.o mdctrl_types.o kpoint_types.o qs_linres_methods.o ri_environment_methods.o qs_elf_methods.o rpa_util.o force_env_types.o qs_linres_nmr_utils.o xas_tdp_integrals.o hfx_helpers.o input_cp2k_ls.o qs_mom_methods.o qs_environment.o qs_vxc_atom.o qs_ot_minimizer.o qs_band_structure.o mp2_grids.o rt_propagation_forces.o qs_active_space_methods.o mp2_eri.o atom_kind_orbitals.o qmmm_tb_coulomb.o sirius_interface.o qs_loc_molecules.o qs_linres_epr_ownutils.o eip_silicon.o optimize_dmfet_potential.o qs_force.o cp_ddapc_forces.o semi_empirical_par_utils.o semi_empirical_utils.o energy_corrections.o topology_util.o preconditioner_makes.o qs_charge_mixing.o admm_dm_types.o qs_rho_atom_methods.o qmmm_force.o cp_ddapc.o negf_subgroup_types.o qs_linres_polar_utils.o libint_2c_3c.o semi_empirical_store_int_types.o xas_methods.o hfx_types.o pao_param_fock.o xas_control.o dm_ls_scf.o qmmm_se_energy.o population_analyses.o mixed_main.o qmmm_elpot.o qs_oce_types.o manybody_siepmann.o topology_types.o qs_scf_types.o f77_interface.o hfx_ri.o qs_block_davidson_types.o mscfg_methods.o mp2_cphf.o colvar_utils.o pilaenv_hack.o almo_scf.o qs_neighbor_list_types.o hirshfeld_types.o pao_optimizer.o fp_methods.o qs_linres_current.o ec_env_types.o qs_tddfpt2_utils.o qmmm_gaussian_init.o force_fields.o topology_cp2k.o qmmm_tb_methods.o efield_utils.o input_cp2k_restarts_util.o spme.o qs_wf_history_types.o global_types.o qs_kpp1_env_methods.o qs_scf_output.o qs_scf_lanczos.o farming_methods.o topology_amber.o qs_linres_atom_current.o mp2_setup.o pao_param_gth.o scine_utils.o qs_epr_hyp.o semi_empirical_int_gks.o optimize_basis_types.o semi_empirical_types.o qs_neighbor_lists.o qs_tddfpt_utils.o qs_tddfpt2_stda_utils.o nnp_environment.o qs_cdft_opt_types.o mol_force.o wannier90.o fist_efield_types.o input_cp2k_nnp.o cp_dbcsr_cholesky.o al_system_types.o xtb_matrices.o qs_matrix_pools.o fist_neighbor_list_types.o kpoint_methods.o atom_operators.o core_ae.o qs_oce_methods.o mixed_environment.o ls_matrix_exp.o qs_ks_qmmm_methods.o atomic_charges.o cp2k_info.o xtb_coulomb.o ipi_driver.o xc_adiabatic_utils.o debug_os_integrals.o qs_mo_occupation.o qs_tensors_types.o qs_elec_field.o moments_utils.o hfx_load_balance_methods.o input_cp2k_poisson.o restraint.o transport.o cp_ddapc_util.o qs_operators_ao.o qs_tddfpt2_fhxc.o s_square_methods.o qs_tddfpt2_stda_types.o almo_scf_types.o qs_fb_matrix_data_types.o qmmm_topology_util.o qs_hash_table_functions.o qs_tddfpt_types.o rtp_admm_methods.o dm_ls_scf_qs.o qs_initial_guess.o qs_kind_types.o distribution_methods.o csvr_system_types.o rpa_main.o rpa_gw.o qs_rho0_ggrid.o linesearch.o input_cp2k_read.o metadynamics_utils.o mao_methods.o atoms_input.o qmmmx_force.o atom_output.o negf_green_cache.o qs_wannier90.o qmmm_links_methods.o qs_local_properties.o input_cp2k_distribution.o input_cp2k_motion_print.o paw_proj_set_types.o qmmm_se_forces.o admm_methods.o commutator_rpnl.o qs_spin_orbit.o mixed_cdft_methods.o rpa_gw_im_time_util.o qs_tensors.o hfx_libint_interface.o almo_scf_optimizer.o qs_linres_op.o cp_subsys_methods.o qs_scf_post_gpw.o xray_diffraction.o ewald_spline_util.o qs_tddfpt2_subgroups.o almo_scf_methods.o header.o hfx_energy_potential.o cp_dbcsr_operations.o mixed_environment_utils.o dm_ls_scf_types.o input_cp2k_almo.o input_cp2k_rsgrid.o xas_tdp_methods.o semi_empirical_expns3_types.o qs_energy_matrix_w.o qmmm_create.o csvr_system_utils.o qs_harmonics_atom.o qmmm_pw_grid.o qs_charges_types.o qs_tddfpt_module.o manybody_quip.o minbas_wfn_analysis.o qs_energy_utils.o rpa_axk.o et_coupling_proj.o pao_param_exp.o graphcon.o molecular_moments.o mp2_laplace.o nnp_environment_types.o atom_types.o kg_vertex_coloring_methods.o input_cp2k_embed.o group_dist_types.o input_cp2k_mp2.o fist_intra_force.o pw_poisson_read_input.o pao_methods.o fist_nonbond_force.o pexsi_methods.o qs_pdos.o hfx_screening_methods.o qs_fermi_contact.o nnp_force.o input_cp2k_thermostats.o qs_interactions.o qs_subsys_types.o free_energy_types.o wannier_states.o atom_energy.o particle_methods.o localization_tb.o pexsi_types.o qs_local_rho_types.o uff_vdw_radii_table.o input_cp2k_loc.o pme_tools.o rpa_gw_ic.o qs_scf_csr_write.o qs_tddfpt2_restart.o qs_dftb_matrices.o se_fock_matrix.o mp2_direct_method.o input_cp2k_binary_restarts.o mscfg_types.o splines_types.o xtb_ehess.o qmmmx_create.o qs_energy_types.o generic_os_integrals.o fist_environment.o et_coupling_types.o topology_constraint_util.o qs_tddfpt2_types.o qs_integrate_potential_single.o input_cp2k_qmmm.o statistical_methods.o topology_multiple_unit_cell.o atom_grb.o mixed_environment_types.o se_core_matrix.o qs_loc_methods.o metadynamics.o qs_p_env_methods.o hfx_pw_methods.o qs_dispersion_nonloc.o qs_basis_gradient.o input_cp2k_external.o commutator_rkinetic.o preconditioner_solvers.o input_cp2k_resp.o qmmm_types.o xc_write_output.o sap_kind_types.o mp2_eri_gpw.o dm_ls_scf_methods.o ct_methods.o force_fields_util.o cp_dbcsr_output.o qmmm_util.o pao_linpot_rotinv.o topology_xyz.o qs_scf_diagonalization.o embed_types.o input_cp2k_check.o atom_fit.o force_field_types.o atom_pseudo.o qs_external_density.o pao_ml.o qs_chargemol.o admm_dm_methods.o pao_main.o mp2_types.o qs_energy.o fist_nonbond_env_types.o qs_fb_filter_matrix_methods.o input_cp2k_atom.o qs_fb_buffer_types.o qs_scf.o xc_adiabatic_methods.o qs_dftb_parameters.o xc_pot_saop.o hartree_local_methods.o lri_environment_types.o qs_dftb_dispersion.o input_optimize_basis.o topology_input.o qmmm_ff_fist.o input_cp2k_neb.o sockets.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmain.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmain.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmain.a lri_ks_methods.o kg_environment_types.o semi_empirical_int_utils.o grrm_utils.o input_cp2k_eip.o qs_diis_types.o qs_scf_initialization.o ewald_methods_tb.o hfx_pair_list_methods.o qs_fb_distribution_methods.o qs_scf_post_scf.o qs_core_energies.o manybody_tersoff.o mao_basis.o qmmm_gaussian_data.o qs_ot_types.o qs_sccs.o qs_update_s_mstruct.o qs_fb_atomic_halo_types.o qs_rho0_types.o preconditioner_apply.o fist_efield_methods.o qs_efield_local.o iterate_matrix.o core_ppnl.o dm_ls_scf_create.o constraint_vsite.o qs_rho_atom_types.o qs_rho_methods.o kpoint_io.o qs_loc_types.o qs_energy_init.o almo_scf_env_methods.o pao_potentials.o submatrix_types.o input_cp2k_free_energy.o cp_external_control.o qs_ks_apply_restraints.o xas_tdp_correction.o xas_tdp_utils.o pexsi_interface.o pair_potential_types.o qs_ks_qmmm_types.o semi_empirical_mpole_types.o qs_grid_atom.o qs_dftb_utils.o qs_efield_berry.o qs_linres_issc_utils.o mp2.o taper_types.o cp2k_debug.o qs_kpp1_env_types.o pao_ml_gaussprocess.o input_cp2k_ec.o qs_ot.o qs_electric_field_gradient.o negf_green_methods.o qs_tddfpt_eigensolver.o stm_images.o preconditioner.o qmmm_gpw_forces.o lri_optimize_ri_basis.o ec_efield_local.o force_env_utils.o qs_tddfpt2_densities.o farming_types.o maxwell_solver_interface.o xtb_parameters.o qs_environment_methods.o se_fock_matrix_dbg.o topology.o topology_gromos.o manybody_eam.o cp_realspace_grid_init.o qs_linres_module.o qs_gcp_utils.o semi_empirical_int_arrays.o xtb_types.o negf_alloc_types.o qs_o3c_methods.o rmsd.o hartree_local_types.o preconditioner_types.o semi_empirical_int_ana.o mixed_cdft_types.o qs_ks_atom.o input_cp2k_mm.o fp_types.o qs_ot_eigensolver.o auto_basis.o optimize_basis_utils.o ec_environment.o constraint_4x6.o hirshfeld_methods.o pao_ml_descriptor.o rt_propagation_types.o semi_empirical_int_num.o subcell_types.o qs_rho0_methods.o dm_ls_scf_curvy.o lri_compression.o fist_neighbor_lists.o bse.o qs_scf_block_davidson.o molden_utils.o atom_xc.o replica_methods.o optbas_opt_utils.o lri_integrals.o motion_utils.o nnp_model.o libint_wrapper.o input_optimize_input.o qs_dispersion_types.o cp_control_types.o mp2_optimize_ri_basis.o ewald_environment_types.o se_fock_matrix_exchange.o qs_kinetic.o pw_env_methods.o qs_scf_loop_utils.o ewald_pw_methods.o fist_neighbor_list_control.o atom_utils.o input_cp2k_global.o dft_plus_u.o molsym.o response_solver.o mao_types.o external_potential_methods.o rpa_kpoints.o virial_methods.o qs_fb_hash_table_types.o qs_dispersion_pairpot.o xas_tp_scf.o atom_optimization.o input_cp2k_colvar.o qmmmx_types.o cp_ddapc_types.o cell_methods.o qs_nl_hash_table_types.o qs_mo_methods.o qs_mo_io.o matrix_exp.o mixed_cdft_utils.o almo_scf_lbfgs_types.o qs_subsys_methods.o ewald_pw_types.o semi_empirical_int_debug.o qs_integrate_potential.o semi_empirical_parameters.o input_cp2k_atprop.o negf_env_types.o pair_potential.o transport_env_types.o library_tests.o optbas_fenv_manipulation.o qmmm_per_elpot.o xas_tdp_atom.o cp_eri_mme_interface.o qs_fb_env_methods.o xas_restart.o qs_linres_types.o input_cp2k_dft.o replica_types.o mp2_ri_grad.o cryssym.o qs_linres_nmr_epr_common_utils.o almo_scf_diis_types.o pwdft_environment.o pao_param.o splines_methods.o metadynamics_types.o qs_o3c_types.o simpar_types.o qs_diis.o qs_ks_types.o qs_gspace_mixing.o admm_types.o block_p_types.o topology_generate_util.o spglib_f08.o qmmm_gpw_energy.o qmmm_gaussian_types.o mao_optimizer.o negf_control_types.o qs_force_types.o qmmm_gaussian_input.o qmmm_types_low.o mm_collocate_potential.o optimize_basis.o molecular_states.o negf_integr_cc.o fist_force.o force_fields_ext.o atom.o minbas_methods.o almo_scf_qs.o manybody_gal.o pao_input.o input_constants.o mm_mapping_library.o pao_ml_neuralnet.o mp2_ri_gpw.o atom_upf.o qs_ks_utils.o qs_gapw_densities.o qs_ot_scf.o et_coupling.o force_fields_input.o se_fock_matrix_coulomb.o input_cp2k_negf.o qs_fb_com_tasks_types.o kg_correction.o pme.o input_cp2k_pwdft.o qs_integrate_potential_product.o qs_overlap.o hfx_communication.o se_core_core.o qs_dftb_coulomb.o topology_connectivity_util.o bsse.o qs_density_mixing_types.o kpoint_coulomb_2c.o qmmm_image_charge.o dm_ls_chebyshev.o qs_linres_current_utils.o qs_localization_methods.o optimize_embedding_potential.o beta_gamma_psi.o topology_coordinate_util.o semi_empirical_int3_utils.o qs_tddfpt2_operators.o input_cp2k_subsys.o input_restart_force_eval.o qs_p_env_types.o rpa_rse.o lri_optimize_ri_basis_types.o qs_condnum.o qs_linres_nmr_shift.o input_cp2k_tb.o force_env_methods.o atom_admm_methods.o input_restart_rng.o input_cp2k_hfx.o kg_environment.o qs_tddfpt2_eigensolver.o semi_empirical_expns3_methods.o pao_io.o lri_environment_methods.o extended_system_types.o environment.o qs_active_space_types.o task_list_methods.o qs_fb_input.o negf_methods.o submatrix_dissection.o lri_environment_init.o qs_dos.o qs_period_efield_types.o shg_integrals_test.o qs_ks_methods.o distribution_2d_types.o wannier_states_types.o qs_collocate_density.o qs_fb_trial_fns_types.o qs_dispersion_utils.o pwdft_environment_types.o qs_dftb_types.o qs_vxc.o qs_outer_scf.o qs_scf_post_se.o eip_environment_types.o atom_electronic_structure.o qs_wf_history_methods.o mode_selective.o mp2_ri_grad_util.o mp2_ri_2c.o topology_xtl.o mixed_energy_types.o ewalds_multipole.o qs_loc_states.o qs_integral_utils.o qs_energy_window.o mp2_gpw.o efield_tb_methods.o qs_mom_types.o negf_vectors.o constraint_fxd.o qs_linres_epr_utils.o qs_tddfpt2_methods.o qs_dftb3_methods.o pair_potential_coulomb.o rel_control_types.o surface_dipole.o qs_loc_utils.o topology_pdb.o input_cp2k_constraints.o pao_types.o fist_environment_types.o hfx_derivatives.o rpa_im_time.o constraint_clv.o qs_core_hamiltonian.o input_cp2k_kpoints.o hfx_compression_methods.o qs_external_potential.o domain_submatrix_types.o topology_psf.o input_cp2k_field.o atom_sgp.o pair_potential_util.o mp2_integrals.o qs_loc_dipole.o qs_resp.o mulliken.o constraint_util.o voronoi_interface.o cp_dbcsr_cp2k_link.o exclusion_types.o negf_atom_map.o input_cp2k_force_eval.o force_fields_all.o negf_integr_simpson.o cp_gemm_interface.o input_cp2k_xc.o fermi_utils.o pao_linpot_full.o constraint.o constraint_3x3.o fist_main.o input_cp2k_properties_dft.o qs_tddfpt2_properties.o rpa_communication.o qmmmx_update.o qs_cdft_scf_utils.o qmmmx_util.o optimize_input.o qs_gcp_method.o ewalds.o fist_pol_scf.o qs_commutators.o core_ppl.o qs_scf_wfn_mix.o hfx_admm_utils.o topology_cif.o mp2_gpw_method.o cp_ddapc_methods.o integration_grid_types.o mao_wfn_analysis.o qs_gamma2kp.o atom_basis.o negf_matrix_utils.o qs_environment_types.o dkh_main.o scf_control_types.o qs_moments.o mp2_ri_libint.o domain_submatrix_methods.o qs_cdft_types.o qs_cdft_methods.o ct_types.o qs_scf_methods.o embed_environment.o qs_mixing_utils.o colvar_methods.o xas_env_types.o outer_scf_control_types.o nnp_acsf.o xas_tdp_kernel.o eip_environment.o embed_main.o negf_integr_utils.o input_cp2k_mixed.o molecular_dipoles.o basis_set_output.o qs_rho_types.o kpoint_transitional.o qs_fb_env_types.o qs_scf_post_tb.o cp_realspace_grid_cube.o qs_gcp_types.o admm_utils.o lri_forces.o rpa_gw_kpoints.o gle_system_types.o semi_empirical_mpole_methods.o cp_symmetry.o qs_fb_atomic_matrix_methods.o pao_param_linpot.o input_cp2k_transport.o kg_tnadd_mat.o se_fock_matrix_integrals.o xas_tdp_types.o manybody_potential.o fist_energy_types.o qs_mo_types.o qs_cdft_utils.o qmmm_init.o semi_empirical_integrals.o cp_dbcsr_diag.o task_list_types.o qs_linres_epr_nablavks.o cp_control_utils.o mdctrl_types.o kpoint_types.o qs_linres_methods.o ri_environment_methods.o qs_elf_methods.o rpa_util.o force_env_types.o qs_linres_nmr_utils.o xas_tdp_integrals.o hfx_helpers.o input_cp2k_ls.o qs_mom_methods.o qs_environment.o qs_vxc_atom.o qs_ot_minimizer.o qs_band_structure.o mp2_grids.o rt_propagation_forces.o qs_active_space_methods.o mp2_eri.o atom_kind_orbitals.o qmmm_tb_coulomb.o sirius_interface.o qs_loc_molecules.o qs_linres_epr_ownutils.o eip_silicon.o optimize_dmfet_potential.o qs_force.o cp_ddapc_forces.o semi_empirical_par_utils.o semi_empirical_utils.o energy_corrections.o topology_util.o preconditioner_makes.o qs_charge_mixing.o admm_dm_types.o qs_rho_atom_methods.o qmmm_force.o cp_ddapc.o negf_subgroup_types.o qs_linres_polar_utils.o libint_2c_3c.o semi_empirical_store_int_types.o xas_methods.o hfx_types.o pao_param_fock.o xas_control.o dm_ls_scf.o qmmm_se_energy.o population_analyses.o mixed_main.o qmmm_elpot.o qs_oce_types.o manybody_siepmann.o topology_types.o qs_scf_types.o f77_interface.o hfx_ri.o qs_block_davidson_types.o mscfg_methods.o mp2_cphf.o colvar_utils.o pilaenv_hack.o almo_scf.o qs_neighbor_list_types.o hirshfeld_types.o pao_optimizer.o fp_methods.o qs_linres_current.o ec_env_types.o qs_tddfpt2_utils.o qmmm_gaussian_init.o force_fields.o topology_cp2k.o qmmm_tb_methods.o efield_utils.o input_cp2k_restarts_util.o spme.o qs_wf_history_types.o global_types.o qs_kpp1_env_methods.o qs_scf_output.o qs_scf_lanczos.o farming_methods.o topology_amber.o qs_linres_atom_current.o mp2_setup.o pao_param_gth.o scine_utils.o qs_epr_hyp.o semi_empirical_int_gks.o optimize_basis_types.o semi_empirical_types.o qs_neighbor_lists.o qs_tddfpt_utils.o qs_tddfpt2_stda_utils.o nnp_environment.o qs_cdft_opt_types.o mol_force.o wannier90.o fist_efield_types.o input_cp2k_nnp.o cp_dbcsr_cholesky.o al_system_types.o xtb_matrices.o qs_matrix_pools.o fist_neighbor_list_types.o kpoint_methods.o atom_operators.o core_ae.o qs_oce_methods.o mixed_environment.o ls_matrix_exp.o qs_ks_qmmm_methods.o atomic_charges.o cp2k_info.o xtb_coulomb.o ipi_driver.o xc_adiabatic_utils.o debug_os_integrals.o qs_mo_occupation.o qs_tensors_types.o qs_elec_field.o moments_utils.o hfx_load_balance_methods.o input_cp2k_poisson.o restraint.o transport.o cp_ddapc_util.o qs_operators_ao.o qs_tddfpt2_fhxc.o s_square_methods.o qs_tddfpt2_stda_types.o almo_scf_types.o qs_fb_matrix_data_types.o qmmm_topology_util.o qs_hash_table_functions.o qs_tddfpt_types.o rtp_admm_methods.o dm_ls_scf_qs.o qs_initial_guess.o qs_kind_types.o distribution_methods.o csvr_system_types.o rpa_main.o rpa_gw.o qs_rho0_ggrid.o linesearch.o input_cp2k_read.o metadynamics_utils.o mao_methods.o atoms_input.o qmmmx_force.o atom_output.o negf_green_cache.o qs_wannier90.o qmmm_links_methods.o qs_local_properties.o input_cp2k_distribution.o input_cp2k_motion_print.o paw_proj_set_types.o qmmm_se_forces.o admm_methods.o commutator_rpnl.o qs_spin_orbit.o mixed_cdft_methods.o rpa_gw_im_time_util.o qs_tensors.o hfx_libint_interface.o almo_scf_optimizer.o qs_linres_op.o cp_subsys_methods.o qs_scf_post_gpw.o xray_diffraction.o ewald_spline_util.o qs_tddfpt2_subgroups.o almo_scf_methods.o header.o hfx_energy_potential.o cp_dbcsr_operations.o mixed_environment_utils.o dm_ls_scf_types.o input_cp2k_almo.o input_cp2k_rsgrid.o xas_tdp_methods.o semi_empirical_expns3_types.o qs_energy_matrix_w.o qmmm_create.o csvr_system_utils.o qs_harmonics_atom.o qmmm_pw_grid.o qs_charges_types.o qs_tddfpt_module.o manybody_quip.o minbas_wfn_analysis.o qs_energy_utils.o rpa_axk.o et_coupling_proj.o pao_param_exp.o graphcon.o molecular_moments.o mp2_laplace.o nnp_environment_types.o atom_types.o kg_vertex_coloring_methods.o input_cp2k_embed.o group_dist_types.o input_cp2k_mp2.o fist_intra_force.o pw_poisson_read_input.o pao_methods.o fist_nonbond_force.o pexsi_methods.o qs_pdos.o hfx_screening_methods.o qs_fermi_contact.o nnp_force.o input_cp2k_thermostats.o qs_interactions.o qs_subsys_types.o free_energy_types.o wannier_states.o atom_energy.o particle_methods.o localization_tb.o pexsi_types.o qs_local_rho_types.o uff_vdw_radii_table.o input_cp2k_loc.o pme_tools.o rpa_gw_ic.o qs_scf_csr_write.o qs_tddfpt2_restart.o qs_dftb_matrices.o se_fock_matrix.o mp2_direct_method.o input_cp2k_binary_restarts.o mscfg_types.o splines_types.o xtb_ehess.o qmmmx_create.o qs_energy_types.o generic_os_integrals.o fist_environment.o et_coupling_types.o topology_constraint_util.o qs_tddfpt2_types.o qs_integrate_potential_single.o input_cp2k_qmmm.o statistical_methods.o topology_multiple_unit_cell.o atom_grb.o mixed_environment_types.o se_core_matrix.o qs_loc_methods.o metadynamics.o qs_p_env_methods.o hfx_pw_methods.o qs_dispersion_nonloc.o qs_basis_gradient.o input_cp2k_external.o commutator_rkinetic.o preconditioner_solvers.o input_cp2k_resp.o qmmm_types.o xc_write_output.o sap_kind_types.o mp2_eri_gpw.o dm_ls_scf_methods.o ct_methods.o force_fields_util.o cp_dbcsr_output.o qmmm_util.o pao_linpot_rotinv.o topology_xyz.o qs_scf_diagonalization.o embed_types.o input_cp2k_check.o atom_fit.o force_field_types.o atom_pseudo.o qs_external_density.o pao_ml.o qs_chargemol.o admm_dm_methods.o pao_main.o mp2_types.o qs_energy.o fist_nonbond_env_types.o qs_fb_filter_matrix_methods.o input_cp2k_atom.o qs_fb_buffer_types.o qs_scf.o xc_adiabatic_methods.o qs_dftb_parameters.o xc_pot_saop.o hartree_local_methods.o lri_environment_types.o qs_dftb_dispersion.o input_optimize_basis.o topology_input.o qmmm_ff_fist.o input_cp2k_neb.o sockets.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmain.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrarnoldi.a' due to: arnoldi_data_methods.o arnoldi_api.o arnoldi_geev.o arnoldi_methods.o arnoldi_types.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrarnoldi.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrarnoldi.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrarnoldi.a arnoldi_data_methods.o arnoldi_api.o arnoldi_geev.o arnoldi_methods.o arnoldi_types.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrarnoldi.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrx.a' due to: dbcsr_vector.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrx.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrx.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrx.a dbcsr_vector.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrx.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kshg_int.a' due to: generic_shg_integrals_init.o s_contract_shg.o constants_operator.o generic_shg_integrals.o construct_shg.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kshg_int.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kshg_int.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kshg_int.a generic_shg_integrals_init.o s_contract_shg.o constants_operator.o generic_shg_integrals.o construct_shg.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kshg_int.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2keri_mme.a' due to: eri_mme_integrate.o eri_mme_types.o eri_mme_error_control.o eri_mme_test.o eri_mme_gaussian.o eri_mme_util.o eri_mme_lattice_summation.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2keri_mme.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2keri_mme.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2keri_mme.a eri_mme_integrate.o eri_mme_types.o eri_mme_error_control.o eri_mme_test.o eri_mme_gaussian.o eri_mme_util.o eri_mme_lattice_summation.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2keri_mme.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kminimax.a' due to: minimax_exp_k15.o minimax_rpa.o minimax_exp.o minimax_exp_gw.o minimax_exp_k53.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kminimax.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kminimax.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kminimax.a minimax_exp_k15.o minimax_rpa.o minimax_exp.o minimax_exp_gw.o minimax_exp_k53.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kminimax.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2khfxbase.a' due to: hfx_contraction_methods.o hfx_compression_core_methods.o hfx_contract_block.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2khfxbase.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2khfxbase.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2khfxbase.a hfx_contraction_methods.o hfx_compression_core_methods.o hfx_contract_block.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2khfxbase.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kxc.a' due to: xc_xbr_pbe_lda_hole_t_c_lr.o xc_derivative_types.o xc_tpss.o xc_lyp_adiabatic.o xc_rho_cflags_types.o xc_optx.o xc_perdew_wang.o xc_xalpha.o xc_b97.o xc_cs1.o xc_xbecke88_lr_adiabatic.o xc_derivatives.o xc_libxc_wrap.o xc_xbecke88.o xc_xwpbe.o xc_sr_lda.o xc_atom.o xc_perdew86.o xc_rho_set_types.o xc_xbecke_roussel.o xc_vwn.o xc_exchange_gga.o xc_pade.o xc_lyp.o xc_libxc.o xc_pbe.o xc_thomas_fermi.o xc_xlda_hole_t_c_lr.o xc_xbeef.o xc_hcth.o xc_functionals_utilities.o cp_linked_list_xc_deriv.o xc.o xc_xpbe_hole_t_c_lr.o xc_ke_gga.o xc_derivative_set_types.o xc_tfw.o xc_xbecke88_long_range.o xc_derivative_desc.o xc_perdew_zunger.o xc_input_constants.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kxc.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kxc.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kxc.a xc_xbr_pbe_lda_hole_t_c_lr.o xc_derivative_types.o xc_tpss.o xc_lyp_adiabatic.o xc_rho_cflags_types.o xc_optx.o xc_perdew_wang.o xc_xalpha.o xc_b97.o xc_cs1.o xc_xbecke88_lr_adiabatic.o xc_derivatives.o xc_libxc_wrap.o xc_xbecke88.o xc_xwpbe.o xc_sr_lda.o xc_atom.o xc_perdew86.o xc_rho_set_types.o xc_xbecke_roussel.o xc_vwn.o xc_exchange_gga.o xc_pade.o xc_lyp.o xc_libxc.o xc_pbe.o xc_thomas_fermi.o xc_xlda_hole_t_c_lr.o xc_xbeef.o xc_hcth.o xc_functionals_utilities.o cp_linked_list_xc_deriv.o xc.o xc_xpbe_hole_t_c_lr.o xc_ke_gga.o xc_derivative_set_types.o xc_tfw.o xc_xbecke88_long_range.o xc_derivative_desc.o xc_perdew_zunger.o xc_input_constants.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kxc.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw_env.a' due to: pw_env_types.o cp_spline_utils.o rs_pw_interface.o gaussian_gridlevels.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw_env.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw_env.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw_env.a pw_env_types.o cp_spline_utils.o rs_pw_interface.o gaussian_gridlevels.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw_env.a /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/all.dep:127: update target '/build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran/dumpdcd.psmp' due to: dumpdcd.o /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmotion.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kthermostat.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kemd.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmain.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgrid.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridhybrid.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcpu.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridref.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcommon.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrarnoldi.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrx.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kshg_int.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2keri_mme.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kminimax.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2khfxbase.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ksubsys.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kxc.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kao.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw_env.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kinput.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfft.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfpga.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfm.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmpiwrap.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:49:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran/dumpdcd.psmp dumpdcd.o -lcp2kmotion -lcp2kthermostat -lcp2kemd -lcp2kmain -lcp2kgrid -lcp2kgridhybrid -lcp2kgridcpu -lcp2kgridref -lcp2kgridcommon -ldbcsrarnoldi -ldbcsrx -lcp2kshg_int -lcp2keri_mme -lcp2kminimax -lcp2khfxbase -lcp2ksubsys -lcp2kxc -lcp2kao -lcp2kpw_env -lcp2kinput -lcp2kpw -lcp2kfft -lcp2kfpga -lcp2kfm -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'xyz2dcd.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/xyz2dcd.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/xyz2dcd.F xyz2dcd.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:49:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/xyz2dcd.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xyz2dcd.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/xyz2dcd.F:602:28: 602 | SUBROUTINE build_h_matrix(a, b, c, alpha, beta, gamma, h) | ^ Warning: ‘build_h_matrix’ defined but not used [-Wunused-function] /build/cp2k-Q381vr/cp2k-8.1/src/motion/xyz2dcd.F:495:114: 495 | WRITE (UNIT=output_unit, FMT="(A5,3(1X,F14.6))") ADJUSTL(atomic_label(iatom)), s_pbc(iatom, 1:3) | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&s_pbc].dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/xyz2dcd.F:58:80: 58 | REAL(KIND=dp), DIMENSION(:, :), ALLOCATABLE :: r, r_pbc, r0, s, s_pbc | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&s_pbc].dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/xyz2dcd.F:491:110: 491 | WRITE (UNIT=output_unit, FMT="(A5,3(1X,F14.6))") ADJUSTL(atomic_label(iatom)), s(iatom, 1:3) | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&s].dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/xyz2dcd.F:58:66: 58 | REAL(KIND=dp), DIMENSION(:, :), ALLOCATABLE :: r, r_pbc, r0, s, s_pbc | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&r_pbc].dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/xyz2dcd.F:809:62: 809 | r_pbc(:, :) = MATMUL(s_pbc(:, :), TRANSPOSE(h(:, :))) | ^ Warning: ‘MEM[(struct array02_real(kind=8) &)&r_pbc].dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/xyz2dcd.F:58:66: 58 | REAL(KIND=dp), DIMENSION(:, :), ALLOCATABLE :: r, r_pbc, r0, s, s_pbc | ^ note: ‘MEM[(struct array02_real(kind=8) &)&r_pbc].dim[0].ubound’ was declared here /build/cp2k-Q381vr/cp2k-8.1/src/motion/xyz2dcd.F:58:66: Warning: ‘r_pbc.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/xyz2dcd.F:485:81: 485 | (r(iatom, 3) - r0(iatom, 3))**2) | ^ Warning: ‘r0.dim[1].stride’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/xyz2dcd.F:485:81: Warning: ‘r0.offset’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/xyz2dcd.F:456:40: 456 | atomic_displacement(:) = 0.0_dp | ^ Warning: ‘atomic_displacement.dim[0].ubound’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/all.dep:131: update target '/build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran/xyz2dcd.psmp' due to: xyz2dcd.o /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmotion.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kthermostat.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kemd.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmain.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgrid.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridhybrid.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcpu.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridref.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcommon.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrarnoldi.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrx.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kshg_int.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2keri_mme.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kminimax.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2khfxbase.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ksubsys.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kxc.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kao.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw_env.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kinput.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfft.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfpga.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfm.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmpiwrap.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:49:29 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran/xyz2dcd.psmp xyz2dcd.o -lcp2kmotion -lcp2kthermostat -lcp2kemd -lcp2kmain -lcp2kgrid -lcp2kgridhybrid -lcp2kgridcpu -lcp2kgridref -lcp2kgridcommon -ldbcsrarnoldi -ldbcsrx -lcp2kshg_int -lcp2keri_mme -lcp2kminimax -lcp2khfxbase -lcp2ksubsys -lcp2kxc -lcp2kao -lcp2kpw_env -lcp2kinput -lcp2kpw -lcp2kfft -lcp2kfpga -lcp2kfm -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_atom.mod' due to: input_cp2k_atom.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_negf.mod' due to: input_cp2k_negf.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_vib.mod' due to: input_cp2k_vib.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_optimize_input.mod' due to: input_optimize_input.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_optimize_basis.mod' due to: input_optimize_basis.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_constraints.mod' due to: input_cp2k_constraints.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'tmc_stati.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_stati.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_stati.F tmc_stati.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:49:29 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_stati.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/tmc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_stati.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'tmc_stati.mod' due to: tmc_stati.o /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_stati.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_tmc.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/tmc/input_cp2k_tmc.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_val_types.mod input_section_types.mod base_hooks.mod kinds.mod bibliography.mod tmc_stati.mod input_cp2k_mm.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/tmc/input_cp2k_tmc.F input_cp2k_tmc.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:49:29 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/input_cp2k_tmc.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/tmc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_tmc.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_tmc.mod' due to: input_cp2k_tmc.o /build/cp2k-Q381vr/cp2k-8.1/src/tmc/input_cp2k_tmc.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_val_types.mod input_section_types.mod base_hooks.mod kinds.mod bibliography.mod tmc_stati.mod input_cp2k_mm.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k_motion.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/start/input_cp2k_motion.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod input_keyword_types.mod input_cp2k_subsys.mod base_hooks.mod kinds.mod input_cp2k_free_energy.mod input_cp2k_motion_print.mod bibliography.mod input_cp2k_md.mod input_cp2k_neb.mod input_cp2k_thermostats.mod input_cp2k_constraints.mod cp_output_handling.mod string_utilities.mod input_constants.mod input_cp2k_tmc.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/start/input_cp2k_motion.F input_cp2k_motion.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:49:31 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"start/input_cp2k_motion.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/start/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_motion.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k_motion.mod' due to: input_cp2k_motion.o /build/cp2k-Q381vr/cp2k-8.1/src/start/input_cp2k_motion.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod input_keyword_types.mod input_cp2k_subsys.mod base_hooks.mod kinds.mod input_cp2k_free_energy.mod input_cp2k_motion_print.mod bibliography.mod input_cp2k_md.mod input_cp2k_neb.mod input_cp2k_thermostats.mod input_cp2k_constraints.mod cp_output_handling.mod string_utilities.mod input_constants.mod input_cp2k_tmc.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'glbopt_input.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/swarm/glbopt_input.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod kinds.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/swarm/glbopt_input.F glbopt_input.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:49:36 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/glbopt_input.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/swarm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' glbopt_input.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'glbopt_input.mod' due to: glbopt_input.o /build/cp2k-Q381vr/cp2k-8.1/src/swarm/glbopt_input.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod kinds.mod bibliography.mod cp_output_handling.mod string_utilities.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'swarm_input.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm_input.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod cp_output_handling.mod string_utilities.mod input_constants.mod glbopt_input.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm_input.F swarm_input.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:49:37 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/swarm_input.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/swarm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' swarm_input.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'swarm_input.mod' due to: swarm_input.o /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm_input.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod cp_output_handling.mod string_utilities.mod input_constants.mod glbopt_input.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'input_cp2k.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/start/input_cp2k.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod string_utilities.mod input_constants.mod kinds.mod input_cp2k_atom.mod input_cp2k_negf.mod input_cp2k_force_eval.mod cp_output_handling.mod input_cp2k_vib.mod input_optimize_input.mod input_cp2k_global.mod shg_integrals_test.mod base_hooks.mod input_cp2k_rsgrid.mod input_optimize_basis.mod cp_eri_mme_interface.mod input_cp2k_motion.mod swarm_input.mod pw_grids.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/start/input_cp2k.F input_cp2k.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:49:37 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"start/input_cp2k.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/start/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'input_cp2k.mod' due to: input_cp2k.o /build/cp2k-Q381vr/cp2k-8.1/src/start/input_cp2k.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod string_utilities.mod input_constants.mod kinds.mod input_cp2k_atom.mod input_cp2k_negf.mod input_cp2k_force_eval.mod cp_output_handling.mod input_cp2k_vib.mod input_optimize_input.mod input_cp2k_global.mod shg_integrals_test.mod base_hooks.mod input_cp2k_rsgrid.mod input_optimize_basis.mod cp_eri_mme_interface.mod input_cp2k_motion.mod swarm_input.mod pw_grids.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ipi_driver.mod' due to: ipi_driver.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'pint_methods.mod' due to: pint_methods.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'neb_methods.mod' due to: neb_methods.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'qs_tddfpt_module.mod' due to: qs_tddfpt_module.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'bsse.mod' due to: bsse.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mc_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod global_types.mod fist_nonbond_env_types.mod force_env_types.mod fist_environment_types.mod pair_potential_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod particle_list_types.mod string_utilities.mod input_constants.mod kinds.mod base_hooks.mod mathconstants.mod physcon.mod cp_files.mod cp_units.mod cp_log_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_types.F mc_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:49:41 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mc_types.mod' due to: mc_types.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod atomic_kind_types.mod molecule_kind_types.mod cell_types.mod global_types.mod fist_nonbond_env_types.mod force_env_types.mod fist_environment_types.mod pair_potential_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod particle_list_types.mod string_utilities.mod input_constants.mod kinds.mod base_hooks.mod mathconstants.mod physcon.mod cp_files.mod cp_units.mod cp_log_handling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mc_environment_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 mc_types.mod force_env_types.mod base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_environment_types.F mc_environment_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:49:49 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_environment_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_environment_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mc_environment_types.mod' due to: mc_environment_types.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_environment_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 mc_types.mod force_env_types.mod base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mc_misc.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_misc.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod mc_types.mod base_hooks.mod kinds.mod mathconstants.mod physcon.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_misc.F mc_misc.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:49:51 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_misc.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_misc.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mc_misc.mod' due to: mc_misc.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_misc.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod mc_types.mod base_hooks.mod kinds.mod mathconstants.mod physcon.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mc_move_control.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_move_control.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 mc_types.mod base_hooks.mod kinds.mod mathconstants.mod physcon.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_move_control.F mc_move_control.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:49:53 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_move_control.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_move_control.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mc_move_control.mod' due to: mc_move_control.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_move_control.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 mc_types.mod base_hooks.mod kinds.mod mathconstants.mod physcon.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'tamc_run.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/tamc_run.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod reftraj_types.mod molecule_kind_list_types.mod atomic_kind_types.mod md_environment_types.mod molecule_kind_types.mod mc_types.mod cell_types.mod global_types.mod mc_environment_types.mod force_env_types.mod thermal_region_types.mod barostat_types.mod atomic_kind_list_types.mod virial_types.mod averages_types.mod particle_types.mod molecule_types.mod input_section_types.mod simpar_types.mod molecule_list_types.mod free_energy_types.mod cp_subsys_types.mod cp_para_types.mod qs_environment_types.mod thermostat_types.mod distribution_1d_types.mod metadynamics_types.mod parallel_rng_types.mod md_ener_types.mod particle_list_types.mod constraint_fxd.mod qs_scf_post_gpw.mod md_energies.mod string_utilities.mod input_constants.mod cp_external_control.mod kinds.mod mc_misc.mod bibliography.mod input_cp2k_check.mod cp_output_handling.mod input_cp2k_restarts.mod md_run.mod wiener_process.mod base_hooks.mod physcon.mod machine.mod reftraj_util.mod reference_manager.mod simpar_methods.mod force_env_methods.mod cp_units.mod thermal_region_utils.mod cp_log_handling.mod thermostat_methods.mod qmmm_util.mod virial_methods.mod mc_move_control.mod colvar_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/tamc_run.F tamc_run.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:49:55 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/tamc_run.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tamc_run.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'tamc_run.mod' due to: tamc_run.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/tamc_run.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod reftraj_types.mod molecule_kind_list_types.mod atomic_kind_types.mod md_environment_types.mod molecule_kind_types.mod mc_types.mod cell_types.mod global_types.mod mc_environment_types.mod force_env_types.mod thermal_region_types.mod barostat_types.mod atomic_kind_list_types.mod virial_types.mod averages_types.mod particle_types.mod molecule_types.mod input_section_types.mod simpar_types.mod molecule_list_types.mod free_energy_types.mod cp_subsys_types.mod cp_para_types.mod qs_environment_types.mod thermostat_types.mod distribution_1d_types.mod metadynamics_types.mod parallel_rng_types.mod md_ener_types.mod particle_list_types.mod constraint_fxd.mod qs_scf_post_gpw.mod md_energies.mod string_utilities.mod input_constants.mod cp_external_control.mod kinds.mod mc_misc.mod bibliography.mod input_cp2k_check.mod cp_output_handling.mod input_cp2k_restarts.mod md_run.mod wiener_process.mod base_hooks.mod physcon.mod machine.mod reftraj_util.mod reference_manager.mod simpar_methods.mod force_env_methods.mod cp_units.mod thermal_region_utils.mod cp_log_handling.mod thermostat_methods.mod qmmm_util.mod virial_methods.mod mc_move_control.mod colvar_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'negf_methods.mod' due to: negf_methods.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'farming_methods.mod' due to: farming_methods.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'optimize_basis.mod' due to: optimize_basis.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'tmc_tree_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_tree_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_tree_types.F tmc_tree_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:50:05 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_tree_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/tmc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_tree_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'tmc_tree_types.mod' due to: tmc_tree_types.o /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_tree_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'tmc_move_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_move_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_move_types.F tmc_move_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:50:06 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_move_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/tmc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_move_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'tmc_move_types.mod' due to: tmc_move_types.o /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_move_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'tmc_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod tmc_tree_types.mod tmc_move_types.mod cell_types.mod cp_para_env.mod base_hooks.mod kinds.mod tmc_stati.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_types.F tmc_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:50:06 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/tmc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'tmc_types.mod' due to: tmc_types.o /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod tmc_tree_types.mod tmc_move_types.mod cell_types.mod cp_para_env.mod base_hooks.mod kinds.mod tmc_stati.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'tmc_analysis_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_analysis_types.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_tree_types.mod cell_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_analysis_types.F tmc_analysis_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:50:07 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_analysis_types.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/tmc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_analysis_types.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'tmc_analysis_types.mod' due to: tmc_analysis_types.o /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_analysis_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_tree_types.mod cell_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'tmc_calculations.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_calculations.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod parallel_rng_types.mod tmc_tree_types.mod tmc_move_types.mod cell_types.mod base_hooks.mod kinds.mod cp_log_handling.mod f77_interface.mod mathconstants.mod physcon.mod tmc_stati.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_calculations.F tmc_calculations.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:50:08 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_calculations.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/tmc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_calculations.F90 /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_calculations.F:134:31: 134 | conf%potential = e_pot | ^ Warning: ‘e_pot’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_calculations.F:134:31: Warning: ‘e_pot’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'tmc_calculations.mod' due to: tmc_calculations.o /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_calculations.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod parallel_rng_types.mod tmc_tree_types.mod tmc_move_types.mod cell_types.mod base_hooks.mod kinds.mod cp_log_handling.mod f77_interface.mod mathconstants.mod physcon.mod tmc_stati.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'tmc_moves.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_moves.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod parallel_rng_types.mod tmc_tree_types.mod tmc_move_types.mod cell_types.mod base_hooks.mod mathlib.mod cp_log_handling.mod kinds.mod tmc_calculations.mod mathconstants.mod physcon.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_moves.F tmc_moves.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:50:11 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_moves.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/tmc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_moves.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'tmc_moves.mod' due to: tmc_moves.o /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_moves.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod parallel_rng_types.mod tmc_tree_types.mod tmc_move_types.mod cell_types.mod base_hooks.mod mathlib.mod cp_log_handling.mod kinds.mod tmc_calculations.mod mathconstants.mod physcon.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'tmc_file_io.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_file_io.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_analysis_types.mod tmc_types.mod tmc_tree_types.mod tmc_move_types.mod base_hooks.mod cp_log_handling.mod kinds.mod tmc_calculations.mod physcon.mod tmc_stati.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_file_io.F tmc_file_io.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:50:16 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_file_io.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/tmc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_file_io.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'tmc_file_io.mod' due to: tmc_file_io.o /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_file_io.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_analysis_types.mod tmc_types.mod tmc_tree_types.mod tmc_move_types.mod base_hooks.mod cp_log_handling.mod kinds.mod tmc_calculations.mod physcon.mod tmc_stati.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'tmc_dot_tree.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_dot_tree.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_tree_types.mod tmc_move_types.mod base_hooks.mod cp_log_handling.mod tmc_file_io.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_dot_tree.F tmc_dot_tree.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:50:19 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_dot_tree.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/tmc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_dot_tree.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'tmc_dot_tree.mod' due to: tmc_dot_tree.o /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_dot_tree.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_tree_types.mod tmc_move_types.mod base_hooks.mod cp_log_handling.mod tmc_file_io.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'tmc_cancelation.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_cancelation.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_tree_types.mod base_hooks.mod cp_log_handling.mod tmc_dot_tree.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_cancelation.F tmc_cancelation.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:50:21 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_cancelation.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/tmc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_cancelation.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'tmc_cancelation.mod' due to: tmc_cancelation.o /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_cancelation.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_tree_types.mod base_hooks.mod cp_log_handling.mod tmc_dot_tree.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'tmc_tree_references.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_tree_references.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_tree_types.mod base_hooks.mod cp_log_handling.mod tmc_cancelation.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_tree_references.F tmc_tree_references.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:50:22 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_tree_references.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/tmc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_tree_references.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'tmc_tree_references.mod' due to: tmc_tree_references.o /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_tree_references.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_tree_types.mod base_hooks.mod cp_log_handling.mod tmc_cancelation.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'tmc_move_handle.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_move_handle.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_tree_types.mod tmc_move_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod mathconstants.mod string_utilities.mod tmc_stati.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_move_handle.F tmc_move_handle.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:50:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_move_handle.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/tmc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_move_handle.F90 /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_move_handle.F:298:16: 298 | IF (move_types%mv_weight(ind) .GT. 0.0) THEN | ^ Warning: ‘ind’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'tmc_move_handle.mod' due to: tmc_move_handle.o /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_move_handle.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_tree_types.mod tmc_move_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod mathconstants.mod string_utilities.mod tmc_stati.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'tmc_tree_search.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_tree_search.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_tree_types.mod base_hooks.mod cp_log_handling.mod kinds.mod tmc_tree_references.mod tmc_stati.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_tree_search.F tmc_tree_search.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:50:26 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_tree_search.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/tmc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_tree_search.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'tmc_tree_search.mod' due to: tmc_tree_search.o /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_tree_search.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_tree_types.mod base_hooks.mod cp_log_handling.mod kinds.mod tmc_tree_references.mod tmc_stati.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'tmc_tree_build.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_tree_build.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_move_types.mod tmc_tree_types.mod base_hooks.mod tmc_moves.mod cp_log_handling.mod tmc_file_io.mod kinds.mod tmc_calculations.mod tmc_tree_references.mod tmc_move_handle.mod tmc_dot_tree.mod tmc_stati.mod tmc_tree_search.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_tree_build.F tmc_tree_build.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:50:28 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_tree_build.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/tmc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_tree_build.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'tmc_tree_build.mod' due to: tmc_tree_build.o /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_tree_build.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_move_types.mod tmc_tree_types.mod base_hooks.mod tmc_moves.mod cp_log_handling.mod tmc_file_io.mod kinds.mod tmc_calculations.mod tmc_tree_references.mod tmc_move_handle.mod tmc_dot_tree.mod tmc_stati.mod tmc_tree_search.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'tmc_messages.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_messages.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod cp_para_types.mod tmc_tree_types.mod base_hooks.mod kinds.mod cp_log_handling.mod tmc_tree_build.mod tmc_move_handle.mod tmc_stati.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_messages.F tmc_messages.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:50:32 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_messages.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/tmc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_messages.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'tmc_messages.mod' due to: tmc_messages.o /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_messages.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod cp_para_types.mod tmc_tree_types.mod base_hooks.mod kinds.mod cp_log_handling.mod tmc_tree_build.mod tmc_move_handle.mod tmc_stati.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'tmc_tree_acceptance.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_tree_acceptance.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_move_types.mod tmc_tree_types.mod base_hooks.mod cp_log_handling.mod kinds.mod tmc_file_io.mod tmc_calculations.mod physcon.mod tmc_tree_build.mod tmc_move_handle.mod tmc_dot_tree.mod tmc_stati.mod tmc_tree_search.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_tree_acceptance.F tmc_tree_acceptance.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:50:38 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_tree_acceptance.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/tmc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_tree_acceptance.F90 /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_tree_acceptance.F:396:10: 396 | IF (parent_ready) THEN | ^ Warning: ‘parent_ready’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'tmc_tree_acceptance.mod' due to: tmc_tree_acceptance.o /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_tree_acceptance.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_move_types.mod tmc_tree_types.mod base_hooks.mod cp_log_handling.mod kinds.mod tmc_file_io.mod tmc_calculations.mod physcon.mod tmc_tree_build.mod tmc_move_handle.mod tmc_dot_tree.mod tmc_stati.mod tmc_tree_search.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'tmc_master.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_master.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod cell_types.mod global_types.mod tmc_types.mod cp_para_types.mod tmc_cancelation.mod tmc_tree_build.mod tmc_messages.mod tmc_dot_tree.mod tmc_move_handle.mod tmc_stati.mod cp_external_control.mod kinds.mod tmc_file_io.mod base_hooks.mod tmc_calculations.mod machine.mod tmc_tree_search.mod tmc_tree_acceptance.mod cp_log_handling.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_master.F tmc_master.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:50:41 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_master.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/tmc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_master.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'tmc_master.mod' due to: tmc_master.o /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_master.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod cell_types.mod global_types.mod tmc_types.mod cp_para_types.mod tmc_cancelation.mod tmc_tree_build.mod tmc_messages.mod tmc_dot_tree.mod tmc_move_handle.mod tmc_stati.mod cp_external_control.mod kinds.mod tmc_file_io.mod base_hooks.mod tmc_calculations.mod machine.mod tmc_tree_search.mod tmc_tree_acceptance.mod cp_log_handling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'tmc_analysis.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_analysis.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_analysis_types.mod tmc_types.mod tmc_tree_types.mod input_section_types.mod cell_types.mod base_hooks.mod force_fields_input.mod cp_log_handling.mod kinds.mod mathlib.mod tmc_file_io.mod tmc_calculations.mod mathconstants.mod physcon.mod tmc_tree_build.mod tmc_stati.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_analysis.F tmc_analysis.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:50:45 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_analysis.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/tmc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_analysis.F90 /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_analysis.F:1131:89: 1131 | REAL(KIND=dp) :: aver_box_scale(3), vol, voldr | ^ Warning: ‘voldr’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'tmc_analysis.mod' due to: tmc_analysis.o /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_analysis.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_analysis_types.mod tmc_types.mod tmc_tree_types.mod input_section_types.mod cell_types.mod base_hooks.mod force_fields_input.mod cp_log_handling.mod kinds.mod mathlib.mod tmc_file_io.mod tmc_calculations.mod mathconstants.mod physcon.mod tmc_tree_build.mod tmc_stati.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'tmc_worker.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_worker.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod cell_types.mod tmc_analysis_types.mod force_env_types.mod cp_result_types.mod tmc_move_types.mod molecule_list_types.mod tmc_types.mod cp_subsys_types.mod cp_para_types.mod particle_list_types.mod tmc_tree_build.mod tmc_messages.mod tmc_move_handle.mod tmc_stati.mod cp_external_control.mod kinds.mod f77_interface.mod tmc_moves.mod tmc_analysis.mod base_hooks.mod tmc_calculations.mod tmc_tree_acceptance.mod cp_log_handling.mod cp_result_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_worker.F tmc_worker.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:50:51 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_worker.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/tmc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_worker.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'tmc_worker.mod' due to: tmc_worker.o /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_worker.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod cell_types.mod tmc_analysis_types.mod force_env_types.mod cp_result_types.mod tmc_move_types.mod molecule_list_types.mod tmc_types.mod cp_subsys_types.mod cp_para_types.mod particle_list_types.mod tmc_tree_build.mod tmc_messages.mod tmc_move_handle.mod tmc_stati.mod cp_external_control.mod kinds.mod f77_interface.mod tmc_moves.mod tmc_analysis.mod base_hooks.mod tmc_calculations.mod tmc_tree_acceptance.mod cp_log_handling.mod cp_result_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'tmc_setup.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_setup.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod global_types.mod tmc_analysis_types.mod input_section_types.mod tmc_types.mod cp_para_types.mod parallel_rng_types.mod tmc_tree_build.mod tmc_master.mod header.mod tmc_move_handle.mod tmc_stati.mod kinds.mod tmc_file_io.mod f77_interface.mod bibliography.mod tmc_worker.mod tmc_analysis.mod cp_para_env.mod base_hooks.mod environment.mod physcon.mod machine.mod cp_files.mod cp_log_handling.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_setup.F tmc_setup.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:50:56 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_setup.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/tmc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_setup.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'tmc_setup.mod' due to: tmc_setup.o /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_setup.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod global_types.mod tmc_analysis_types.mod input_section_types.mod tmc_types.mod cp_para_types.mod parallel_rng_types.mod tmc_tree_build.mod tmc_master.mod header.mod tmc_move_handle.mod tmc_stati.mod kinds.mod tmc_file_io.mod f77_interface.mod bibliography.mod tmc_worker.mod tmc_analysis.mod cp_para_env.mod base_hooks.mod environment.mod physcon.mod machine.mod cp_files.mod cp_log_handling.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'library_tests.mod' due to: library_tests.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mscfg_methods.mod' due to: mscfg_methods.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'glbopt_history.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/swarm/glbopt_history.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/swarm/glbopt_history.F glbopt_history.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:51:01 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/glbopt_history.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/swarm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' glbopt_history.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'glbopt_history.mod' due to: glbopt_history.o /build/cp2k-Q381vr/cp2k-8.1/src/swarm/glbopt_history.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'swarm_message.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm_message.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_parser_types.mod base_hooks.mod kinds.mod cp_parser_methods.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm_message.F swarm_message.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:51:02 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/swarm_message.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/swarm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' swarm_message.F90 /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm_message.F:254:41: 254 | curr_entry => curr_entry%next | ^ Warning: ‘curr_entry’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'swarm_message.mod' due to: swarm_message.o /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm_message.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_parser_types.mod base_hooks.mod kinds.mod cp_parser_methods.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'glbopt_minhop.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/swarm/glbopt_minhop.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod physcon.mod bibliography.mod glbopt_history.mod swarm_message.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/swarm/glbopt_minhop.F glbopt_minhop.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:51:05 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/glbopt_minhop.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/swarm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' glbopt_minhop.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'glbopt_minhop.mod' due to: glbopt_minhop.o /build/cp2k-Q381vr/cp2k-8.1/src/swarm/glbopt_minhop.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod physcon.mod bibliography.mod glbopt_history.mod swarm_message.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'glbopt_mincrawl.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/swarm/glbopt_mincrawl.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod parallel_rng_types.mod particle_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod swarm_message.mod glbopt_history.mod cp_output_handling.mod input_constants.mod particle_methods.mod cp_units.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/swarm/glbopt_mincrawl.F glbopt_mincrawl.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:51:07 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/glbopt_mincrawl.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/swarm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' glbopt_mincrawl.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'glbopt_mincrawl.mod' due to: glbopt_mincrawl.o /build/cp2k-Q381vr/cp2k-8.1/src/swarm/glbopt_mincrawl.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod parallel_rng_types.mod particle_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod swarm_message.mod glbopt_history.mod cp_output_handling.mod input_constants.mod particle_methods.mod cp_units.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'glbopt_master.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/swarm/glbopt_master.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod atomic_kind_types.mod molecule_kind_types.mod exclusion_types.mod particle_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod input_constants.mod particle_methods.mod glbopt_minhop.mod kinds.mod cp_output_handling.mod topology.mod base_hooks.mod cp_units.mod cp_log_handling.mod swarm_message.mod glbopt_mincrawl.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/swarm/glbopt_master.F glbopt_master.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:51:09 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/glbopt_master.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/swarm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' glbopt_master.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'glbopt_master.mod' due to: glbopt_master.o /build/cp2k-Q381vr/cp2k-8.1/src/swarm/glbopt_master.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod atomic_kind_types.mod molecule_kind_types.mod exclusion_types.mod particle_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod input_constants.mod particle_methods.mod glbopt_minhop.mod kinds.mod cp_output_handling.mod topology.mod base_hooks.mod cp_units.mod cp_log_handling.mod swarm_message.mod glbopt_mincrawl.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'swarm_master.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm_master.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod global_types.mod cp_parser_types.mod base_hooks.mod cp_external_control.mod cp_log_handling.mod kinds.mod glbopt_master.mod swarm_message.mod cp_output_handling.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm_master.F swarm_master.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:51:11 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/swarm_master.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/swarm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' swarm_master.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'swarm_master.mod' due to: swarm_master.o /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm_master.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod global_types.mod cp_parser_types.mod base_hooks.mod cp_external_control.mod cp_log_handling.mod kinds.mod glbopt_master.mod swarm_message.mod cp_output_handling.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'glbopt_worker.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/swarm/glbopt_worker.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod cp_subsys_types.mod cp_para_types.mod mdctrl_types.mod input_section_types.mod global_types.mod base_hooks.mod geo_opt.mod f77_interface.mod kinds.mod physcon.mod swarm_message.mod md_run.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/swarm/glbopt_worker.F glbopt_worker.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:51:12 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/glbopt_worker.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/swarm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' glbopt_worker.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'glbopt_worker.mod' due to: glbopt_worker.o /build/cp2k-Q381vr/cp2k-8.1/src/swarm/glbopt_worker.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod cp_subsys_types.mod cp_para_types.mod mdctrl_types.mod input_section_types.mod global_types.mod base_hooks.mod geo_opt.mod f77_interface.mod kinds.mod physcon.mod swarm_message.mod md_run.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'swarm_worker.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm_worker.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod swarm_message.mod glbopt_worker.mod cp_output_handling.mod input_constants.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm_worker.F swarm_worker.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:51:15 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/swarm_worker.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/swarm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' swarm_worker.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'swarm_worker.mod' due to: swarm_worker.o /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm_worker.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod kinds.mod swarm_message.mod glbopt_worker.mod cp_output_handling.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'swarm_mpi.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm_mpi.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_iter_types.mod input_section_types.mod cp_para_env.mod base_hooks.mod cp_log_handling.mod kinds.mod swarm_message.mod machine.mod message_passing.mod cp_files.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm_mpi.F swarm_mpi.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:51:17 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/swarm_mpi.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/swarm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' swarm_mpi.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'swarm_mpi.mod' due to: swarm_mpi.o /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm_mpi.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_iter_types.mod input_section_types.mod cp_para_env.mod base_hooks.mod cp_log_handling.mod kinds.mod swarm_message.mod machine.mod message_passing.mod cp_files.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'swarm.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod global_types.mod base_hooks.mod cp_log_handling.mod kinds.mod swarm_master.mod swarm_message.mod cp_output_handling.mod swarm_worker.mod swarm_mpi.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm.F swarm.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:51:18 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/swarm.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/swarm/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' swarm.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'swarm.mod' due to: swarm.o /build/cp2k-Q381vr/cp2k-8.1/src/swarm/swarm.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod global_types.mod base_hooks.mod cp_log_handling.mod kinds.mod swarm_master.mod swarm_message.mod cp_output_handling.mod swarm_worker.mod swarm_mpi.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mc_control.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_control.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod atomic_kind_types.mod molecule_kind_types.mod mc_types.mod cell_types.mod global_types.mod force_env_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod parallel_rng_types.mod particle_list_types.mod kinds.mod f77_interface.mod mc_misc.mod base_hooks.mod physcon.mod cp_files.mod cp_log_handling.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_control.F mc_control.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:51:20 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_control.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_control.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_control.F:289:54: 289 | atom_symbols(iunit) = atom_names(iunit, 1) | 1 Warning: CHARACTER expression will be truncated in assignment (5/80) at (1) [-Wcharacter-truncation] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mc_control.mod' due to: mc_control.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_control.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod atomic_kind_types.mod molecule_kind_types.mod mc_types.mod cell_types.mod global_types.mod force_env_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod parallel_rng_types.mod particle_list_types.mod kinds.mod f77_interface.mod mc_misc.mod base_hooks.mod physcon.mod cp_files.mod cp_log_handling.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mc_coordinates.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_coordinates.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod cp_subsys_types.mod mc_types.mod parallel_rng_types.mod molecule_types.mod particle_list_types.mod cell_types.mod base_hooks.mod kinds.mod mathconstants.mod physcon.mod message_passing.mod force_env_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_coordinates.F mc_coordinates.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:51:23 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_coordinates.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_coordinates.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mc_coordinates.mod' due to: mc_coordinates.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_coordinates.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod cp_subsys_types.mod mc_types.mod parallel_rng_types.mod molecule_types.mod particle_list_types.mod cell_types.mod base_hooks.mod kinds.mod mathconstants.mod physcon.mod message_passing.mod force_env_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mc_moves.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_moves.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod atomic_kind_types.mod molecule_kind_types.mod mc_types.mod cell_types.mod global_types.mod force_env_types.mod cp_subsys_types.mod parallel_rng_types.mod particle_list_types.mod kinds.mod md_run.mod base_hooks.mod mathconstants.mod physcon.mod mc_coordinates.mod force_env_methods.mod cp_log_handling.mod message_passing.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_moves.F mc_moves.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:51:29 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_moves.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_moves.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mc_moves.mod' due to: mc_moves.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_moves.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod atomic_kind_types.mod molecule_kind_types.mod mc_types.mod cell_types.mod global_types.mod force_env_types.mod cp_subsys_types.mod parallel_rng_types.mod particle_list_types.mod kinds.mod md_run.mod base_hooks.mod mathconstants.mod physcon.mod mc_coordinates.mod force_env_methods.mod cp_log_handling.mod message_passing.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mc_ge_moves.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_ge_moves.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 mc_types.mod cell_types.mod force_env_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod parallel_rng_types.mod particle_list_types.mod input_constants.mod particle_methods.mod kinds.mod mc_misc.mod base_hooks.mod physcon.mod mc_coordinates.mod force_env_methods.mod mc_control.mod message_passing.mod mc_move_control.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_ge_moves.F mc_ge_moves.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:51:38 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_ge_moves.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_ge_moves.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_ge_moves.F:544:65: 544 | moves(molecule_type, insert_box)%moves%swap%attempts + 1 | ^ Warning: ‘molecule_type’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_ge_moves.F:1092:38: 1092 | DEALLOCATE (test_env_bias) | ^ Warning: ‘test_env_bias.data’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mc_ge_moves.mod' due to: mc_ge_moves.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_ge_moves.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 mc_types.mod cell_types.mod force_env_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod parallel_rng_types.mod particle_list_types.mod input_constants.mod particle_methods.mod kinds.mod mc_misc.mod base_hooks.mod physcon.mod mc_coordinates.mod force_env_methods.mod mc_control.mod message_passing.mod mc_move_control.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mc_ensembles.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_ensembles.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 mc_types.mod cell_types.mod global_types.mod mc_environment_types.mod force_env_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod parallel_rng_types.mod particle_list_types.mod input_constants.mod particle_methods.mod cp_external_control.mod kinds.mod mc_misc.mod mc_moves.mod base_hooks.mod mathconstants.mod physcon.mod machine.mod mc_coordinates.mod cp_files.mod force_env_methods.mod cp_units.mod cp_log_handling.mod mc_ge_moves.mod mc_control.mod message_passing.mod mc_move_control.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_ensembles.F mc_ensembles.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:51:46 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_ensembles.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_ensembles.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_ensembles.F:142:66: 142 | start_atom, start_atom_swap, start_atom_target, start_mol | ^ Warning: ‘start_mol’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mc_ensembles.mod' due to: mc_ensembles.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_ensembles.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 mc_types.mod cell_types.mod global_types.mod mc_environment_types.mod force_env_types.mod input_section_types.mod cp_subsys_types.mod cp_para_types.mod parallel_rng_types.mod particle_list_types.mod input_constants.mod particle_methods.mod cp_external_control.mod kinds.mod mc_misc.mod mc_moves.mod base_hooks.mod mathconstants.mod physcon.mod machine.mod mc_coordinates.mod cp_files.mod force_env_methods.mod cp_units.mod cp_log_handling.mod mc_ge_moves.mod mc_control.mod message_passing.mod mc_move_control.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'mc_run.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_run.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod cp_para_types.mod parallel_rng_types.mod mc_types.mod input_section_types.mod global_types.mod mc_environment_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod mc_control.mod mc_ensembles.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_run.F mc_run.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:51:56 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_run.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_run.F90 /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_run.F:171:36: 171 | ALLOCATE (force_env(1:nboxes)) | ^ Warning: ‘nboxes’ may be used uninitialized in this function [-Wmaybe-uninitialized] /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'mc_run.mod' due to: mc_run.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/mc/mc_run.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod cp_para_types.mod parallel_rng_types.mod mc_types.mod input_section_types.mod global_types.mod mc_environment_types.mod base_hooks.mod cp_log_handling.mod kinds.mod physcon.mod mc_control.mod mc_ensembles.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'atom.mod' due to: atom.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp2k_debug.mod' due to: cp2k_debug.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cell_opt.mod' due to: cell_opt.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'optimize_input.mod' due to: optimize_input.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'vibrational_analysis.mod' due to: vibrational_analysis.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp2k_runs.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/start/cp2k_runs.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 global_types.mod force_env_types.mod cp_control_types.mod cp_parser_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod farming_types.mod input_keyword_types.mod input_parsing.mod cp2k_info.mod cp_dbcsr_cp2k_link.mod pw_fpga.mod ipi_driver.mod string_utilities.mod rt_propagation.mod input_constants.mod pint_methods.mod neb_methods.mod kinds.mod f77_interface.mod qs_tddfpt_module.mod bibliography.mod input_cp2k_check.mod cp_output_handling.mod bsse.mod pw_cuda.mod tamc_run.mod input_cp2k_global.mod md_run.mod cp_para_env.mod negf_methods.mod qs_linres_module.mod base_hooks.mod farming_methods.mod geo_opt.mod optimize_basis.mod environment.mod input_cp2k_read.mod cuda_profiling.mod tmc_setup.mod machine.mod sirius_interface.mod library_tests.mod mscfg_methods.mod reference_manager.mod swarm.mod cp_files.mod force_env_methods.mod cp_units.mod mc_run.mod cp_log_handling.mod atom.mod cp2k_debug.mod cell_opt.mod input_cp2k.mod optimize_input.mod vibrational_analysis.mod message_passing.mod grid_api.mod cp_parser_methods.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/start/cp2k_runs.F cp2k_runs.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:52:00 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"start/cp2k_runs.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/start/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp2k_runs.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp2k_runs.mod' due to: cp2k_runs.o /build/cp2k-Q381vr/cp2k-8.1/src/start/cp2k_runs.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 global_types.mod force_env_types.mod cp_control_types.mod cp_parser_types.mod input_section_types.mod cp_para_types.mod qs_environment_types.mod farming_types.mod input_keyword_types.mod input_parsing.mod cp2k_info.mod cp_dbcsr_cp2k_link.mod pw_fpga.mod ipi_driver.mod string_utilities.mod rt_propagation.mod input_constants.mod pint_methods.mod neb_methods.mod kinds.mod f77_interface.mod qs_tddfpt_module.mod bibliography.mod input_cp2k_check.mod cp_output_handling.mod bsse.mod pw_cuda.mod tamc_run.mod input_cp2k_global.mod md_run.mod cp_para_env.mod negf_methods.mod qs_linres_module.mod base_hooks.mod farming_methods.mod geo_opt.mod optimize_basis.mod environment.mod input_cp2k_read.mod cuda_profiling.mod tmc_setup.mod machine.mod sirius_interface.mod library_tests.mod mscfg_methods.mod reference_manager.mod swarm.mod cp_files.mod force_env_methods.mod cp_units.mod mc_run.mod cp_log_handling.mod atom.mod cp2k_debug.mod cell_opt.mod input_cp2k.mod optimize_input.mod vibrational_analysis.mod message_passing.mod grid_api.mod cp_parser_methods.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp2k_shell.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/start/cp2k_shell.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod input_constants.mod cp2k_info.mod f77_interface.mod input_cp2k_read.mod kinds.mod physcon.mod machine.mod string_utilities.mod message_passing.mod cp_files.mod cp2k_runs.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/start/cp2k_shell.F cp2k_shell.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:52:09 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"start/cp2k_shell.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/start/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp2k_shell.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp2k_shell.mod' due to: cp2k_shell.o /build/cp2k-Q381vr/cp2k-8.1/src/start/cp2k_shell.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod input_constants.mod cp2k_info.mod f77_interface.mod input_cp2k_read.mod kinds.mod physcon.mod machine.mod string_utilities.mod message_passing.mod cp_files.mod cp2k_runs.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'cp2k.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/start/cp2k.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod f77_interface.mod cp2k_info.mod machine.mod input_cp2k.mod input_constants.mod cp2k_runs.mod cp2k_shell.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/start/cp2k.F cp2k.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:52:12 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"start/cp2k.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/start/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp2k.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'libcp2k.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/start/libcp2k.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod qs_environment_types.mod qs_active_space_types.mod qs_mo_types.mod input_section_types.mod cp_fm_types.mod base_hooks.mod kinds.mod f77_interface.mod cp2k_info.mod input_cp2k_read.mod input_cp2k.mod cp2k_runs.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/start/libcp2k.F libcp2k.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:52:14 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"start/libcp2k.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/start/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' libcp2k.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kstart.a' due to: libcp2k.o input_cp2k_motion.o cp2k_runs.o cp2k_shell.o input_cp2k.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kstart.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kstart.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kstart.a libcp2k.o input_cp2k_motion.o cp2k_runs.o cp2k_shell.o input_cp2k.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kstart.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmc.a' due to: mc_run.o tamc_run.o mc_coordinates.o mc_types.o mc_ensembles.o mc_moves.o mc_move_control.o mc_environment_types.o mc_control.o mc_ge_moves.o mc_misc.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmc.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmc.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmc.a mc_run.o tamc_run.o mc_coordinates.o mc_types.o mc_ensembles.o mc_moves.o mc_move_control.o mc_environment_types.o mc_control.o mc_ge_moves.o mc_misc.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmc.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kswarm.a' due to: swarm_master.o swarm_input.o glbopt_history.o swarm_message.o swarm_mpi.o glbopt_mincrawl.o glbopt_minhop.o glbopt_input.o swarm.o swarm_worker.o glbopt_worker.o glbopt_master.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kswarm.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kswarm.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kswarm.a swarm_master.o swarm_input.o glbopt_history.o swarm_message.o swarm_mpi.o glbopt_mincrawl.o glbopt_minhop.o glbopt_input.o swarm.o swarm_worker.o glbopt_worker.o glbopt_master.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kswarm.a /build/cp2k-Q381vr/cp2k-8.1/Makefile:504: update target 'tmc_utils.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_utils.F /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod /build/cp2k-Q381vr/cp2k-8.1/tools/build_utils/fypp -n /build/cp2k-Q381vr/cp2k-8.1/src/tmc/tmc_utils.F tmc_utils.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:52:19 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_utils.F\"" -I'/build/cp2k-Q381vr/cp2k-8.1/src/tmc/' -I'/build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_utils.F90 /build/cp2k-Q381vr/cp2k-8.1/Makefile:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ktmc.a' due to: tmc_analysis_types.o tmc_setup.o tmc_file_io.o tmc_moves.o tmc_tree_types.o tmc_tree_search.o input_cp2k_tmc.o tmc_tree_build.o tmc_calculations.o tmc_tree_acceptance.o tmc_stati.o tmc_master.o tmc_utils.o tmc_cancelation.o tmc_types.o tmc_messages.o tmc_move_types.o tmc_worker.o tmc_tree_references.o tmc_dot_tree.o tmc_move_handle.o tmc_analysis.o echo "Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ktmc.a" Updating archive /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ktmc.a ar -r /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ktmc.a tmc_analysis_types.o tmc_setup.o tmc_file_io.o tmc_moves.o tmc_tree_types.o tmc_tree_search.o input_cp2k_tmc.o tmc_tree_build.o tmc_calculations.o tmc_tree_acceptance.o tmc_stati.o tmc_master.o tmc_utils.o tmc_cancelation.o tmc_types.o tmc_messages.o tmc_move_types.o tmc_worker.o tmc_tree_references.o tmc_dot_tree.o tmc_move_handle.o tmc_analysis.o ar: creating /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ktmc.a /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/all.dep:119: update target '/build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran/cp2k.psmp' due to: cp2k.o /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kstart.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmc.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kswarm.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmotion.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kthermostat.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kemd.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ktmc.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmain.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgrid.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridhybrid.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcpu.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridref.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcommon.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrarnoldi.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrx.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kshg_int.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2keri_mme.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kminimax.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2khfxbase.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ksubsys.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kxc.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kao.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw_env.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kinput.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfft.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfpga.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfm.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmpiwrap.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:52:19 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran/cp2k.psmp cp2k.o -lcp2kstart -lcp2kmc -lcp2kswarm -lcp2kmotion -lcp2kthermostat -lcp2kemd -lcp2ktmc -lcp2kmain -lcp2kgrid -lcp2kgridhybrid -lcp2kgridcpu -lcp2kgridref -lcp2kgridcommon -ldbcsrarnoldi -ldbcsrx -lcp2kshg_int -lcp2keri_mme -lcp2kminimax -lcp2khfxbase -lcp2ksubsys -lcp2kxc -lcp2kao -lcp2kpw_env -lcp2kinput -lcp2kpw -lcp2kfft -lcp2kfpga -lcp2kfm -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa /build/cp2k-Q381vr/cp2k-8.1/Makefile:508: update target 'libcp2k_unittest.o' due to: /build/cp2k-Q381vr/cp2k-8.1/src/start/libcp2k_unittest.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a /build/cp2k-Q381vr/cp2k-8.1/src/start/libcp2k.h mpicc -c -g -Wall -O2 -fopenmp /build/cp2k-Q381vr/cp2k-8.1/src/start/libcp2k_unittest.c /build/cp2k-Q381vr/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/all.dep:143: update target '/build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran/libcp2k_unittest.psmp' due to: libcp2k_unittest.o /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kstart.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmc.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kswarm.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmotion.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kthermostat.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kemd.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ktmc.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmain.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgrid.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridhybrid.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcpu.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridref.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcommon.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrarnoldi.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrx.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kshg_int.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2keri_mme.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kminimax.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2khfxbase.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ksubsys.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kxc.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kao.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw_env.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kinput.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfft.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfpga.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfm.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmpiwrap.a /build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Mon Oct 18 22:52:27 UTC 2021\"" -D__COMPILE_HOST="\"f82459f3d30f\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran/libcp2k_unittest.psmp libcp2k_unittest.o -lcp2kstart -lcp2kmc -lcp2kswarm -lcp2kmotion -lcp2kthermostat -lcp2kemd -lcp2ktmc -lcp2kmain -lcp2kgrid -lcp2kgridhybrid -lcp2kgridcpu -lcp2kgridref -lcp2kgridcommon -ldbcsrarnoldi -ldbcsrx -lcp2kshg_int -lcp2keri_mme -lcp2kminimax -lcp2khfxbase -lcp2ksubsys -lcp2kxc -lcp2kao -lcp2kpw_env -lcp2kinput -lcp2kpw -lcp2kfft -lcp2kfpga -lcp2kfm -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa /build/cp2k-Q381vr/cp2k-8.1/Makefile:237: update target '/build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran/cp2k_shell.psmp' due to: /build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran/cp2k.psmp cd /build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran; ln -sf cp2k.psmp cp2k_shell.psmp /build/cp2k-Q381vr/cp2k-8.1/Makefile:234: update target '/build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran/cp2k.popt' due to: /build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran/cp2k.psmp cd /build/cp2k-Q381vr/cp2k-8.1/exe/Linux-x86_64-gfortran; ln -sf cp2k.psmp cp2k.popt make[2]: Leaving directory '/build/cp2k-Q381vr/cp2k-8.1' cd tools/manual && \ /build/cp2k-Q381vr/cp2k-8.1/exe/*/cp2k.psmp --xml && \ saxonb-xslt -o index.html -ext:on cp2k_input.xml cp2k_input.xsl make[1]: Leaving directory '/build/cp2k-Q381vr/cp2k-8.1' debian/rules override_dh_auto_test make[1]: Entering directory '/build/cp2k-Q381vr/cp2k-8.1' debian/rules:52: target 'override_dh_auto_test' does not exist (cd tools/regtesting; ARCH=Linux-`uname -m`-gfortran ./do_regtest \ -config ../../debian/regtest.config \ -restrictdir ATOM/regtest-2 \ -restrictdir DFTB/regtest-nonscc \ -restrictdir FARMING/regtest-1 \ -restrictdir FE/regtest-2 \ -restrictdir Fist/regtest-11 \ -restrictdir LIBTEST \ -restrictdir MC/regtest \ -restrictdir NEB/regtest-1 \ -restrictdir optimize_input/regtest-1 \ -restrictdir QMMM/QS/regtest-2-erf \ -restrictdir QMMM/QS/regtest-4 \ -restrictdir QMMM/QS/regtest-gapw \ -restrictdir QMMM/QS/regtest-lrigpw \ -restrictdir QMMM/SE/regtest_2 \ -restrictdir QMMM/DFTB/regtest \ -restrictdir QS/regtest-almo-eda \ -restrictdir QS/regtest-cdft-3-1 \ -restrictdir QS/regtest-dm-ls-scf-4 \ -restrictdir QS/regtest-epr-2 \ -restrictdir QS/regtest-fftw \ -restrictdir QS/regtest-gapw-2 \ -restrictdir QS/regtest-gpw-2-1 \ -restrictdir QS/regtest-hirshfeld \ -restrictdir QS/regtest-linearscaling \ -restrictdir QS/regtest-lsroks \ -restrictdir QS/regtest-md-lgvregion \ -restrictdir QS/regtest-nmr-2 \ -restrictdir QS/regtest-optbas \ -restrictdir QS/regtest-ot-refine-3 \ -restrictdir QS/regtest-pao-3 \ -restrictdir QS/regtest-polar \ -restrictdir QS/regtest-properties/resp \ -restrictdir QS/regtest-ps-implicit-2-3 \ -restrictdir QS/regtest-sccs-2 \ -restrictdir QS/regtest-tddfpt \ -restrictdir SCPTB/regtest-1 \ -restrictdir SE/regtest-3-1 \ -restrictdir SWARM/regtest-glbopt-1 \ -restrictdir TAMC/regtest \ -restrictdir QS/regtest-hfx-periodic \ -restrictdir QS/regtest-hfx-stress \ -restrictdir QS/regtest-hybrid-1 \ -restrictdir QS/regtest-libxc \ -restrictdir QS/regtest-mp2-1 \ -restrictdir QS/regtest-mp2-grad \ -restrictdir QS/regtest-ri-rpa ) ./do_regtest: line 620: ps: command not found *************************** testing started ****************************** started on Mon Oct 18 22:53:33 UTC 2021 configuration: Linux-x86_64-gfortran-psmp regtesting location summary file: /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/summary.txt regtesting location error_summary file: /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/error_summary regtesting location memory_summary file: /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/memory_summary regtesting location output dir: /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33 regtesting location last dir: /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//LAST-Linux-x86_64-gfortran-psmp ---------------------------- Settings ------------------------------------ maxtasks = 2 numprocs = 1 OMP_NUM_THREADS = 2 cp2k_run_prefix = cp2k_run_postfix = cp2k_prefix = /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..///exe/Linux-x86_64-gfortran/cp2k.psmp cp2k_postfix = cp2k_version = psmp dir_triplet = Linux-x86_64-gfortran job_max_time = 400 leakcheck = NO doretest = no nobuild = nobuild quick = quick shard = 1 / 1 skiptest = noskiptest do_unit_test = yes farming = no maxbuildtasks = 2 mem_limit = unlimited restrict_dirs = ATOM/regtest-2 restrict_dirs = DFTB/regtest-nonscc restrict_dirs = FARMING/regtest-1 restrict_dirs = FE/regtest-2 restrict_dirs = Fist/regtest-11 restrict_dirs = LIBTEST restrict_dirs = MC/regtest restrict_dirs = NEB/regtest-1 restrict_dirs = optimize_input/regtest-1 restrict_dirs = QMMM/QS/regtest-2-erf restrict_dirs = QMMM/QS/regtest-4 restrict_dirs = QMMM/QS/regtest-gapw restrict_dirs = QMMM/QS/regtest-lrigpw restrict_dirs = QMMM/SE/regtest_2 restrict_dirs = QMMM/DFTB/regtest restrict_dirs = QS/regtest-almo-eda restrict_dirs = QS/regtest-cdft-3-1 restrict_dirs = QS/regtest-dm-ls-scf-4 restrict_dirs = QS/regtest-epr-2 restrict_dirs = QS/regtest-fftw restrict_dirs = QS/regtest-gapw-2 restrict_dirs = QS/regtest-gpw-2-1 restrict_dirs = QS/regtest-hirshfeld restrict_dirs = QS/regtest-linearscaling restrict_dirs = QS/regtest-lsroks restrict_dirs = QS/regtest-md-lgvregion restrict_dirs = QS/regtest-nmr-2 restrict_dirs = QS/regtest-optbas restrict_dirs = QS/regtest-ot-refine-3 restrict_dirs = QS/regtest-pao-3 restrict_dirs = QS/regtest-polar restrict_dirs = QS/regtest-properties/resp restrict_dirs = QS/regtest-ps-implicit-2-3 restrict_dirs = QS/regtest-sccs-2 restrict_dirs = QS/regtest-tddfpt restrict_dirs = SCPTB/regtest-1 restrict_dirs = SE/regtest-3-1 restrict_dirs = SWARM/regtest-glbopt-1 restrict_dirs = TAMC/regtest restrict_dirs = QS/regtest-hfx-periodic restrict_dirs = QS/regtest-hfx-stress restrict_dirs = QS/regtest-hybrid-1 restrict_dirs = QS/regtest-libxc restrict_dirs = QS/regtest-mp2-1 restrict_dirs = QS/regtest-mp2-grad restrict_dirs = QS/regtest-ri-rpa --------------------------- GIT ------------------------------------------ CommitSHA: --------------------------- Resource limits ------------------------------ RESOURCE DESCRIPTION SOFT HARD UNITS AS address space limit unlimited unlimited bytes CORE max core file size unlimited unlimited bytes CPU CPU time unlimited unlimited seconds DATA max data size unlimited unlimited bytes FSIZE max file size unlimited unlimited bytes LOCKS max number of file locks held unlimited unlimited locks MEMLOCK max locked-in-memory address space 65536 65536 bytes MSGQUEUE max bytes in POSIX mqueues 819200 819200 bytes NICE max nice prio allowed to raise 0 0 NOFILE max number of open files 1024 1048576 files NPROC max number of processes unlimited unlimited processes RSS max resident set size unlimited unlimited bytes RTPRIO max real-time priority 0 0 RTTIME timeout for real-time tasks unlimited unlimited microsecs SIGPENDING max number of pending signals 515364 515364 signals STACK max stack size 8388608 unlimited bytes --------------------------- SELinux -------------------------------------- No SELinux installation found --------------------------- Preparations --------------------------------- Quick testing, no realclean No build, continue regression testing ------------------------ regtesting cp2k --------------------------------- ------------------------- dynamic libraries linked ----------------------- ldd /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..///exe/Linux-x86_64-gfortran/cp2k.psmp : linux-vdso.so.1 (0x00007ffc49ffb000) liblapack.so.3 => /usr/lib/x86_64-linux-gnu/liblapack.so.3 (0x00007fc11c9bf000) libblas.so.3 => /usr/lib/x86_64-linux-gnu/libblas.so.3 (0x00007fc11c952000) libfftw3.so.3 => /usr/lib/x86_64-linux-gnu/libfftw3.so.3 (0x00007fc11c74b000) libfftw3_threads.so.3 => /usr/lib/x86_64-linux-gnu/libfftw3_threads.so.3 (0x00007fc11c742000) libint2.so.2 => /usr/lib/x86_64-linux-gnu/libint2.so.2 (0x00007fc11a4b8000) libxcf03.so.5 => /usr/lib/x86_64-linux-gnu/libxcf03.so.5 (0x00007fc11a4af000) libsymspg.so.1 => /usr/lib/x86_64-linux-gnu/libsymspg.so.1 (0x00007fc11a45d000) libmpi_mpifh.so.40 => /usr/lib/x86_64-linux-gnu/libmpi_mpifh.so.40 (0x00007fc11a3f9000) libscalapack-openmpi.so.2.1 => /usr/lib/x86_64-linux-gnu/libscalapack-openmpi.so.2.1 (0x00007fc119e51000) libelpa.so.15 => /usr/lib/x86_64-linux-gnu/libelpa.so.15 (0x00007fc119d78000) libgfortran.so.5 => /usr/lib/x86_64-linux-gnu/libgfortran.so.5 (0x00007fc119ac2000) libm.so.6 => /lib/x86_64-linux-gnu/libm.so.6 (0x00007fc11997e000) libmvec.so.1 => /lib/x86_64-linux-gnu/libmvec.so.1 (0x00007fc119950000) libgomp.so.1 => /usr/lib/x86_64-linux-gnu/libgomp.so.1 (0x00007fc119910000) libgcc_s.so.1 => /lib/x86_64-linux-gnu/libgcc_s.so.1 (0x00007fc1198f6000) libpthread.so.0 => /lib/x86_64-linux-gnu/libpthread.so.0 (0x00007fc1198d4000) libc.so.6 => /lib/x86_64-linux-gnu/libc.so.6 (0x00007fc11970f000) libstdc++.so.6 => /usr/lib/x86_64-linux-gnu/libstdc++.so.6 (0x00007fc119542000) libxc.so.5 => /usr/lib/x86_64-linux-gnu/libxc.so.5 (0x00007fc118ef4000) libmpi.so.40 => /usr/lib/x86_64-linux-gnu/libmpi.so.40 (0x00007fc118dcb000) libopen-pal.so.40 => /usr/lib/x86_64-linux-gnu/libopen-pal.so.40 (0x00007fc118d17000) libquadmath.so.0 => /usr/lib/x86_64-linux-gnu/libquadmath.so.0 (0x00007fc118cce000) /lib64/ld-linux-x86-64.so.2 (0x00007fc11ffb6000) libdl.so.2 => /lib/x86_64-linux-gnu/libdl.so.2 (0x00007fc118cc6000) libopen-rte.so.40 => /usr/lib/x86_64-linux-gnu/libopen-rte.so.40 (0x00007fc118c0a000) libhwloc.so.15 => /usr/lib/x86_64-linux-gnu/libhwloc.so.15 (0x00007fc118bb1000) libutil.so.1 => /lib/x86_64-linux-gnu/libutil.so.1 (0x00007fc118bac000) libevent_core-2.1.so.7 => /usr/lib/x86_64-linux-gnu/libevent_core-2.1.so.7 (0x00007fc118b72000) libevent_pthreads-2.1.so.7 => /usr/lib/x86_64-linux-gnu/libevent_pthreads-2.1.so.7 (0x00007fc118b6d000) libz.so.1 => /lib/x86_64-linux-gnu/libz.so.1 (0x00007fc118b4e000) libudev.so.1 => /usr/lib/x86_64-linux-gnu/libudev.so.1 (0x00007fc118b26000) -------------------------------------------------------------------------- Copying tests into working directory ... done! CP2K supports: cp2kflags: omp libint fftw3 libxc elpa parallel mpi3 scalapack spglib Skipping QS/regtest-cdft-hirshfeld-2 : missing required feature : mpiranks>1 Skipping SIRIUS/regtest-1 : missing required feature : sirius Skipping QMMM/QS/regtest-cdft : missing required feature : mpiranks==2||mpiranks==4||mpiranks==6||mpiranks==16||mpiranks==24 Skipping QS/regtest-rma : missing required feature : mpiranks==4 Skipping QS/regtest-cdft-3 : missing required feature : mpiranks==2||mpiranks==4||mpiranks==6||mpiranks==16||mpiranks==24 Skipping LIBTEST/libvori : missing required feature : libvori Skipping LIBTEST/libbqb : missing required feature : libbqb Skipping QS/regtest-pexsi : missing required feature : pexsi Skipping QS/regtest-rma-3D : missing required feature : mpiranks==8 Skipping TMC/regtest_ana_on_the_fly : missing required feature : mpiranks>2 Skipping TMC/regtest : missing required feature : mpiranks>1 Skipping TMC/regtest_ana_post_proc : missing required feature : mpiranks>1 Skipping Fist/regtest-quip : missing required feature : quip Skipping Fist/regtest-plumed2 : missing required feature : plumed2 Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-mp2-grad (1 of 45) Running H2O_grad_mme.inp Running H2O_grad_gpw.inp Running H2_H2_no_freeHFX.inp Running O2_dyn.inp Running O2_dyn_mme.inp Running CH_dyn_screen.inp Running MOM_MP2_geoopt.inp Running H2O_MD_mme.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-mp2-grad H2O_grad_mme.inp -16.766973159454466 OK ( 35.81 sec) H2O_grad_gpw.inp -16.990049885807217 OK ( 45.49 sec) H2_H2_no_freeHFX.inp -2.307711033963880 OK ( 31.65 sec) O2_dyn.inp -31.519148246527720 OK ( 23.77 sec) O2_dyn_mme.inp 0.50585576 OK ( 36.42 sec) CH_dyn_screen.inp -5.700371305121173 OK ( 32.25 sec) MOM_MP2_geoopt.inp -13.969021709456747 OK ( 39.32 sec) H2O_MD_mme.inp -17.056807611801222 OK ( 43.46 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-mp2-grad (1 of 45) done in 300.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-ri-rpa (2 of 45) Running RI_RPA_H2O.inp Running RI_RPA_H2O_overlap_metric.inp Running RI_RPA_CH3.inp Running RI_RPA_H2O_SYRK.inp Running RI_RPA_minimax_H_atom.inp Running RI_RPA_H2O_minimax.inp Running RI_RPA_H2O_PBE0.inp Running RI_RPA_H2O_PBE0_ADMM1.inp Running RI_RPA_H2O_Obara_Saika.inp Running RI_RPA_H2O_svd.inp Running RI_RPA_H2O_overlap_metric_svd.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-ri-rpa RI_RPA_H2O.inp -17.145691221375827 OK ( 26.74 sec) RI_RPA_H2O_overlap_metric.inp -17.145538849243536 OK ( 26.94 sec) RI_RPA_CH3.inp -7.415612316029151 OK ( 31.34 sec) RI_RPA_H2O_SYRK.inp -17.145691221375827 OK ( 24.90 sec) RI_RPA_minimax_H_atom.inp -0.510122901484671 OK ( 13.88 sec) RI_RPA_H2O_minimax.inp -17.145691263471022 OK ( 25.94 sec) RI_RPA_H2O_PBE0.inp -17.122863632433329 OK ( 29.41 sec) RI_RPA_H2O_PBE0_ADMM1.inp -17.125217824055309 OK ( 38.37 sec) RI_RPA_H2O_Obara_Saika.inp -17.160204463747334 OK ( 13.26 sec) RI_RPA_H2O_svd.inp -17.145632690184627 OK ( 23.69 sec) RI_RPA_H2O_overlap_metric_svd.inp -17.145498315844495 OK ( 19.10 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-ri-rpa (2 of 45) done in 289.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-tddfpt (3 of 45) Running H2O_tddfpt-s-1.inp Running H2O_tddfpt-t-1.inp Running NO_tddfpt-s-1.inp Running NO_tddfpt-t-1.inp Running H2O_tddfpt-s-2.inp Running H2O_tddfpt-t-2.inp Running NO_tddfpt-t-2.inp Running H2O_tddfpt-s-3.inp Running H2O_tddfpt-t-3.inp Running NO_tddfpt-s-3.inp Running NO_tddfpt-t-3.inp Running H2O_tddfpt_NTO.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-tddfpt H2O_tddfpt-s-1.inp 0.602948E+00 OK ( 3.98 sec) H2O_tddfpt-t-1.inp 0.304878E+00 OK ( 2.85 sec) NO_tddfpt-s-1.inp 0.348494E+00 OK ( 20.09 sec) NO_tddfpt-t-1.inp 0.359779E+00 OK ( 20.49 sec) H2O_tddfpt-s-2.inp 0.543390E+00 OK ( 4.01 sec) H2O_tddfpt-t-2.inp 0.548605E+00 OK ( 4.98 sec) NO_tddfpt-t-2.inp 0.358683E+00 OK ( 18.21 sec) H2O_tddfpt-s-3.inp 0.543390E+00 OK ( 3.67 sec) H2O_tddfpt-t-3.inp 0.579030E+00 OK ( 4.12 sec) NO_tddfpt-s-3.inp 0.350929E+00 OK ( 10.96 sec) NO_tddfpt-t-3.inp 0.358683E+00 OK ( 16.78 sec) H2O_tddfpt_NTO.inp 0.551476E+00 OK ( 10.47 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-tddfpt (3 of 45) done in 138.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-libxc (4 of 45) Running H2O-hybrid-b3lyp_libxc_uks.inp Running H2O_pbe_libxc_tddfpt-s.inp Running H2O_lda_libxc_tddfpt-s.inp Running H2O_pbe_libxc_tddfpt-t_uks.inp Running H2O-hybrid-b3lyp_libxc.inp Running H2O-hybrid-tpssh_libxc.inp Running H2O_lda_libxc_tddfpt-t_uks.inp Running H2O-tpssx_libxc.inp Running diamond_br89_libxc_uks.inp Running diamond_br89_libxc.inp Running H2O-tpss_lsd.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-libxc H2O-hybrid-b3lyp_libxc_uks.inp -76.41035426581185 OK ( 15.39 sec) H2O_pbe_libxc_tddfpt-s.inp -17.23116251470411 OK ( 15.21 sec) H2O_lda_libxc_tddfpt-s.inp -17.13289833455466 OK ( 11.89 sec) H2O_pbe_libxc_tddfpt-t_uks.inp -17.23116251474723 OK ( 28.72 sec) H2O-hybrid-b3lyp_libxc.inp -76.41035426581183 OK ( 9.42 sec) H2O-hybrid-tpssh_libxc.inp -76.40918264715266 OK ( 13.21 sec) H2O_lda_libxc_tddfpt-t_uks.inp -17.13289833455855 OK ( 25.45 sec) H2O-tpssx_libxc.inp -33.88300963208438 OK ( 14.60 sec) diamond_br89_libxc_uks.inp -11.06581614908316 OK ( 116.50 sec) diamond_br89_libxc.inp -11.06581614908315 OK ( 57.20 sec) H2O-tpss_lsd.inp -34.34060245665610 OK ( 27.72 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-libxc (4 of 45) done in 350.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-hfx-periodic (5 of 45) Running H2O-trunc-2.inp Running H2O-trunc-auto.inp Running H2O-coul-0.inp Running H2O-trunc-auto-md.inp Running CH3-trunc-auto.inp Running CH3-trunc-1.inp Running CH3-trunc-auto-md.inp Running CH3-coul-0.inp Running h2o-respa.inp Running h2o-respa_restart.inp Running H2O-id-auto.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-hfx-periodic H2O-trunc-2.inp -75.99943504501115 OK ( 8.31 sec) H2O-trunc-auto.inp -75.99943504501111 OK ( 9.03 sec) H2O-coul-0.inp -76.02314790926961 OK ( 7.37 sec) H2O-trunc-auto-md.inp -0.752385976642E+02 OK ( 15.08 sec) CH3-trunc-auto.inp -39.13005530688503 OK ( 13.43 sec) CH3-trunc-1.inp -39.36116309682869 OK ( 15.75 sec) CH3-trunc-auto-md.inp -0.387264301986E+02 OK ( 31.51 sec) CH3-coul-0.inp -39.39910229689072 OK ( 16.48 sec) h2o-respa.inp -76.02310918726096 OK ( 66.43 sec) h2o-respa_restart.inp -76.02267217092384 OK ( 46.62 sec) H2O-id-auto.inp -88.00800458675087 OK ( 8.15 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-hfx-periodic (5 of 45) done in 256.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-polar (6 of 45) Running h2o_LRraman.inp Running h2o_LRraman_loc.inp Running h2o_LRraman_noort.inp Running H2O_md_polar.inp Running xTB_LRraman.inp Running xTB_LRraman_loc.inp Running h2o_LRraman_LRI.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-polar h2o_LRraman.inp 0.006125121412 OK ( 2.50 sec) h2o_LRraman_loc.inp 0.009153812508 OK ( 36.71 sec) h2o_LRraman_noort.inp 0.023303680948 OK ( 11.31 sec) H2O_md_polar.inp 0.635316385439 OK ( 96.34 sec) xTB_LRraman.inp 0.804852847403 OK ( 0.49 sec) xTB_LRraman_loc.inp 0.804852847403 OK ( 0.53 sec) h2o_LRraman_LRI.inp 0.004262314774 OK ( 9.40 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-polar (6 of 45) done in 168.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-sccs-2 (7 of 45) Running H2O_sccs_otdiis_cd5.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-sccs-2 H2O_sccs_otdiis_cd5.inp -17.22654049703096 OK ( 50.05 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-sccs-2 (7 of 45) done in 52.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/MC/regtest (8 of 45) Running MC_QS.inp Running MC_QS_restart.inp Running GEMC_NpT_box1.inp Running GEMC_NVT_box1.inp Running GEMC_swap_box1.inp Running canonical.inp Running canonical_bias.inp Running virial.inp Running hmc.inp Running MC_QS_cluster.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/MC/regtest MC_QS.inp -51.34794469 OK ( 9.13 sec) MC_QS_restart.inp -51.34909000 OK ( 11.03 sec) GEMC_NpT_box1.inp 0.49826574 OK ( 3.72 sec) GEMC_NVT_box1.inp 0.49803069 OK ( 4.15 sec) GEMC_swap_box1.inp 0.55872200 OK ( 6.95 sec) canonical.inp 0.55333815 OK ( 0.39 sec) canonical_bias.inp 0.38566238 OK ( 1.97 sec) virial.inp -.723498E+03 OK ( 3.45 sec) hmc.inp -2.49775342 OK ( 52.51 sec) MC_QS_cluster.inp -123.50714373283105 OK ( 82.21 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/MC/regtest (8 of 45) done in 190.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-ps-implicit-2-3 (9 of 45) Running H2O_mixed_periodic_cuboidal.inp Running H2O_mixed_periodic_cylindrical.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-ps-implicit-2-3 H2O_mixed_periodic_cuboidal.inp -17.23631232134920 OK ( 97.41 sec) H2O_mixed_periodic_cylindrical.inp -17.32193400042427 OK ( 54.27 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-ps-implicit-2-3 (9 of 45) done in 155.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/ATOM/regtest-2 (10 of 45) Running H.inp Running He_1.inp Running He_2.inp Running He_3.inp Running He_5.inp Running F_1.inp Running F_2.inp Running F_3.inp Running F_4.inp Running F_5.inp Running U.inp Running Ru.inp Running Ru_basis.inp Running Ru_conf.inp Running atom_1.inp Running atom_2.inp Running atom_3.inp Running atom_4.inp Running atom_5.inp Running atom_c1.inp Running atom_c2.inp Running atom_c3.inp Running atom_c4.inp Running atom_c5.inp Running slater_0.inp Running slater_1.inp Running slater_2.inp Running slater_3.inp Running slater_4.inp Running slater_5.inp Running slater_6.inp Running slater_7.inp Running slater_8.inp Running slater_9.inp Running slater_10.inp Running Hg.inp Running C.inp Running C_ADMM.inp Running C_tpss.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/ATOM/regtest-2 H.inp -0.499999999830 OK ( 0.37 sec) He_1.inp -1.399307796698 OK ( 0.05 sec) He_2.inp -1.336212351224 OK ( 0.03 sec) He_3.inp -1.416270865184 OK ( 0.02 sec) He_5.inp -1.408879880907 OK ( 0.06 sec) F_1.inp -24.171954774816 OK ( 0.27 sec) F_2.inp -24.171954774816 OK ( 0.14 sec) F_3.inp -24.171954774816 OK ( 0.20 sec) F_4.inp -23.517790822115 OK ( 0.13 sec) F_5.inp -23.437623684262 OK ( 0.11 sec) U.inp -25598.253318868839 OK ( 7.48 sec) Ru.inp -15.9518066199 OK ( 12.14 sec) Ru_basis.inp -15.951806619855 OK ( 0.20 sec) Ru_conf.inp -15.9897774741 OK ( 19.15 sec) atom_1.inp -0.462506882641 OK ( 0.21 sec) atom_2.inp -0.356859139125 OK ( 0.11 sec) atom_3.inp -0.462506882641 OK ( 0.24 sec) atom_4.inp -0.146531730136 OK ( 0.13 sec) atom_5.inp -0.462506882641 OK ( 0.09 sec) atom_c1.inp -0.460470116001 OK ( 0.08 sec) atom_c2.inp -0.348633649362 OK ( 0.03 sec) atom_c3.inp -0.460470116001 OK ( 0.05 sec) atom_c4.inp -0.038182392054 OK ( 0.11 sec) atom_c5.inp -0.460470116001 OK ( 0.09 sec) slater_0.inp -2.847630187388 OK ( 0.03 sec) slater_1.inp -526.292493965898 OK ( 0.02 sec) slater_2.inp -24.243036046113 OK ( 1.01 sec) slater_3.inp -2.838751324071 OK ( 0.13 sec) slater_4.inp 8.063992740899 OK ( 0.04 sec) slater_5.inp 109583.1142107928 OK ( 0.14 sec) slater_6.inp 3762956.0611208631 OK ( 0.31 sec) slater_7.inp -2.8616551247 OK ( 1.09 sec) slater_8.inp -0.1875976021 OK ( 0.19 sec) slater_9.inp -525.7615443522 OK ( 0.23 sec) slater_10.inp -2.841058209720 OK ( 0.03 sec) Hg.inp -19601.624766751003 OK ( 3.66 sec) C.inp -37.799871796427 OK ( 0.41 sec) C_ADMM.inp -37.758721798836 OK ( 0.28 sec) C_tpss.inp -37.801438870459 OK ( 0.49 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/ATOM/regtest-2 (10 of 45) done in 99.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/LIBTEST (11 of 45) Running test_01.inp Running test_02.inp Running test_pw.inp Running test_pw_02.inp Running test_pw_03.inp Running test_pw_04.inp Running test_pw_05.inp Running test_cp_fm_gemm_01.inp Running test_cp_fm_gemm_02.inp Running eig.inp Running dbcsr_mm_blas.inp Running dbcsr_multistack.inp Running dbcsr_types.inp Running dbcsr_blocks_01.inp Running dbcsr_blocks_02.inp Running dbcsr_blocks_03.inp Running dbcsr_blocks_04.inp Running dbcsr_blocks_05.inp Running dbcsr_types_01.inp Running dbcsr_types_02.inp Running dbcsr_types_03.inp Running dbcsr_types_04.inp Running dbcsr_types_05.inp Running dbcsr_io_1.inp Running dbcsr_order_N.inp Running test_eri_mme_accuracy.inp Running test_eri_mme_accuracy_longrange.inp Running test_eri_mme_accuracy_yukawa.inp Running test_eri_mme_performance.inp Running test_minimax.inp Running test_shg_integrals_01.inp Running test_shg_integrals_02.inp Running grid_ref_backend_ortho.inp Running grid_validate_ortho.inp Running grid_ref_backend_nonortho.inp Running grid_validate_nonortho.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/LIBTEST test_01.inp - OK ( 8.33 sec) test_02.inp - OK ( 1.86 sec) test_pw.inp - OK ( 0.77 sec) test_pw_02.inp - OK ( 0.01 sec) test_pw_03.inp - OK ( 0.01 sec) test_pw_04.inp - OK ( 15.35 sec) test_pw_05.inp - OK ( 0.02 sec) test_cp_fm_gemm_01.inp - OK ( 2.16 sec) test_cp_fm_gemm_02.inp - OK ( 1.90 sec) eig.inp - OK ( 0.01 sec) dbcsr_mm_blas.inp - OK ( 0.24 sec) dbcsr_multistack.inp - OK ( 0.87 sec) dbcsr_types.inp - OK ( 0.80 sec) dbcsr_blocks_01.inp 20978908949.261906 OK ( 3.49 sec) dbcsr_blocks_02.inp 21229174127.238159 OK ( 4.08 sec) dbcsr_blocks_03.inp 21561533688.640675 OK ( 3.98 sec) dbcsr_blocks_04.inp 21304439095.777740 OK ( 3.00 sec) dbcsr_blocks_05.inp 21455488291.450737 OK ( 3.29 sec) dbcsr_types_01.inp 272584373.29241335 OK ( 0.89 sec) dbcsr_types_02.inp 272584373.29241335 OK ( 0.96 sec) dbcsr_types_03.inp 272584373.29241335 OK ( 0.84 sec) dbcsr_types_04.inp 272584373.29241335 OK ( 0.85 sec) dbcsr_types_05.inp 272584373.29241335 OK ( 0.86 sec) dbcsr_io_1.inp - OK ( 0.59 sec) dbcsr_order_N.inp 1910924.8949438259 OK ( 11.85 sec) test_eri_mme_accuracy.inp - OK ( 2.46 sec) test_eri_mme_accuracy_longrange.inp - OK ( 2.50 sec) test_eri_mme_accuracy_yukawa.inp - OK ( 2.36 sec) test_eri_mme_performance.inp - OK ( 3.67 sec) test_minimax.inp - OK ( 1.36 sec) test_shg_integrals_01.inp - OK ( 5.11 sec) test_shg_integrals_02.inp - OK ( 1.54 sec) grid_ref_backend_ortho.inp -21.04944231395036 OK ( 2.63 sec) grid_validate_ortho.inp -21.04944231395037 OK ( 2.72 sec) grid_ref_backend_nonortho.inp -18.04976254477839 OK ( 1.07 sec) grid_validate_nonortho.inp -18.04976254477841 OK ( 1.86 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/LIBTEST (11 of 45) done in 139.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-hfx-stress (12 of 45) Running ch3-admm.inp Running ch3.inp Running ch4-admm.inp Running h2o.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-hfx-stress ch3-admm.inp -7.17220679278E+00 OK ( 59.05 sec) ch3.inp 2.83902802123E+01 OK ( 23.49 sec) ch4-admm.inp -7.10694854621E+00 OK ( 41.65 sec) h2o.inp 1.26297506368E+01 OK ( 12.60 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-hfx-stress (12 of 45) done in 143.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/DFTB/regtest-nonscc (13 of 45) Running ch2o-1.inp Running ch2o-2.inp Running ch2o-3.inp Running ch2o-r.inp Running h2-1.inp Running h2-2.inp Running h2-3.inp Running h2-4.inp Running h2o-32_1.inp Running h2o-32_2.inp Running h2o-32_3.inp Running h2o-32_4.inp Running MoS.inp Running n2.inp Running s2.inp Running ch2o_atprop.inp Running MoS_atprop.inp Running h2o-32_atprop.inp Running co2_1.inp Running co2_2.inp Running co2_3.inp Running si_kp1.inp Running si_kp2.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/DFTB/regtest-nonscc ch2o-1.inp -5.82072731467941 OK ( 0.12 sec) ch2o-2.inp -5.82159061359820 OK ( 0.29 sec) ch2o-3.inp -5.81373413468792 OK ( 0.30 sec) ch2o-r.inp -5.81373413468792 OK ( 0.34 sec) h2-1.inp -0.70875565358819 OK ( 0.09 sec) h2-2.inp -0.70875565358819 OK ( 0.06 sec) h2-3.inp -0.70875565358819 OK ( 0.07 sec) h2-4.inp -0.71042952969308 OK ( 0.40 sec) h2o-32_1.inp -131.08636939008764 OK ( 2.42 sec) h2o-32_2.inp -131.07999691054354 OK ( 2.73 sec) h2o-32_3.inp -131.07520911566405 OK ( 1.48 sec) h2o-32_4.inp -131.07520911521181 OK ( 14.56 sec) MoS.inp -2.99616182900092 OK ( 0.46 sec) n2.inp -4.86560729572791 OK ( 3.15 sec) s2.inp -4.83731808711856 OK ( 0.55 sec) ch2o_atprop.inp -5.81281420275335 OK ( 0.09 sec) MoS_atprop.inp -2.99616182900092 OK ( 0.46 sec) h2o-32_atprop.inp -131.08636939008764 OK ( 2.31 sec) co2_1.inp -8.55586246566685 OK ( 0.12 sec) co2_2.inp -8.55586246566686 OK ( 0.12 sec) co2_3.inp -8.55586246566686 OK ( 0.11 sec) si_kp1.inp -10.06358203475393 OK ( 3.00 sec) si_kp2.inp - OK ( 25.53 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/DFTB/regtest-nonscc (13 of 45) done in 88.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-hirshfeld (14 of 45) Running htest_1.inp Running htest_2.inp Running htest_3.inp Running htest_4.inp Running htest_5.inp Running htest_6.inp Running htest_7.inp Running htest_8.inp Running htest_9.inp Running hlsd_1.inp Running hlsd_2.inp Running hlsd_3.inp Running hlsd_4.inp Running hlsd_5.inp Running hlsd_6.inp Running hlsd_7.inp Running hlsd_8.inp Running hlsd_9.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-hirshfeld htest_1.inp -17.14603641519601 OK ( 1.38 sec) htest_2.inp -17.14603641519600 OK ( 0.98 sec) htest_3.inp -17.14603641519600 OK ( 0.98 sec) htest_4.inp -17.14603641519600 OK ( 1.26 sec) htest_5.inp -17.14603641519601 OK ( 1.38 sec) htest_6.inp -17.14603641519601 OK ( 1.35 sec) htest_7.inp -17.13771713041177 OK ( 1.59 sec) htest_8.inp -17.13771713041175 OK ( 1.68 sec) htest_9.inp -17.13771713041176 OK ( 2.02 sec) hlsd_1.inp -16.81101156813313 OK ( 2.19 sec) hlsd_2.inp -16.81101156813313 OK ( 3.42 sec) hlsd_3.inp -16.81101156813313 OK ( 2.67 sec) hlsd_4.inp -16.81101156813313 OK ( 2.34 sec) hlsd_5.inp -16.81101156813313 OK ( 2.92 sec) hlsd_6.inp -16.80070757658129 OK ( 2.74 sec) hlsd_7.inp -16.80070757658129 OK ( 2.87 sec) hlsd_8.inp -16.80070757658128 OK ( 3.46 sec) hlsd_9.inp -16.80070757658129 OK ( 3.67 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-hirshfeld (14 of 45) done in 63.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-gpw-2-1 (15 of 45) Running H2-vib.inp Running H2-vib_tc.inp Running H2O-2.inp Running H2O-3.inp Running H2O-4.inp Running ZrO.inp Running Ar-12.inp Running Ar-13.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-gpw-2-1 H2-vib.inp 3855.524137 OK ( 23.53 sec) H2-vib_tc.inp -5.75148845 OK ( 27.50 sec) H2O-2.inp -17.14619644944920 OK ( 3.29 sec) H2O-3.inp -17.14553123442888 OK ( 3.38 sec) H2O-4.inp -17.14677584577017 OK ( 3.72 sec) ZrO.inp -62.20520122490161 OK ( 1.39 sec) Ar-12.inp -21.04251999575885 OK ( 2.94 sec) Ar-13.inp -21.12624107439688 OK ( 3.13 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-gpw-2-1 (15 of 45) done in 81.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QMMM/DFTB/regtest (16 of 45) Running wdim_scc.inp Running wdim_nonscc.inp Running wdimmc_scc.inp Running wdimmc_nonscc.inp Running epc_1.inp Running epc_2.inp Running epc_3.inp Running epc_4.inp Running fdeb_1.inp Running fdeb_2.inp Running fdeb_3.inp Running fdeb_4.inp Running fdeb_5.inp Running fdeb_6.inp Running fdeb_7.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QMMM/DFTB/regtest wdim_scc.inp -4.07355023693330 OK ( 0.21 sec) wdim_nonscc.inp -4.10498450145550 OK ( 0.17 sec) wdimmc_scc.inp -4.07060757309577 OK ( 0.42 sec) wdimmc_nonscc.inp -4.10169797261566 OK ( 0.30 sec) epc_1.inp -4.07357205844602 OK ( 0.42 sec) epc_2.inp -4.07355023693330 OK ( 0.29 sec) epc_3.inp -4.10500910796087 OK ( 0.20 sec) epc_4.inp -4.07358020377115 OK ( 0.37 sec) fdeb_1.inp - OK ( 4.91 sec) fdeb_2.inp - OK ( 5.52 sec) fdeb_3.inp - OK ( 4.75 sec) fdeb_4.inp - OK ( 6.63 sec) fdeb_5.inp - OK ( 4.66 sec) fdeb_6.inp - OK ( 6.81 sec) fdeb_7.inp - OK ( 7.86 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QMMM/DFTB/regtest (16 of 45) done in 64.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QMMM/QS/regtest-gapw (17 of 45) Running C11H24-qmmmgapwall-gauss-0.inp Running C11H24-qmmmgapw-gauss-0.inp Running H2O-qmmm-gapw-fdbg.inp Running H2O-qmmm-hfx.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QMMM/QS/regtest-gapw C11H24-qmmmgapwall-gauss-0.inp -156.88271046730759 OK ( 9.07 sec) C11H24-qmmmgapw-gauss-0.inp -28.0421973526 OK ( 9.64 sec) H2O-qmmm-gapw-fdbg.inp -16.93909155475012 OK ( 30.76 sec) H2O-qmmm-hfx.inp -0.176043379384E+02 OK ( 20.37 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QMMM/QS/regtest-gapw (17 of 45) done in 76.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QMMM/QS/regtest-4 (18 of 45) Running crys_per_qmmm.inp Running crys_per_qmmm_anal.inp Running crys_per_qmmm_spln.inp Running crys_per_qmmm_none.inp Running acn-qmmm-re.inp Running acn-conn-1.inp Running wat_nacl.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QMMM/QS/regtest-4 crys_per_qmmm.inp -0.08375440741138 OK ( 6.34 sec) crys_per_qmmm_anal.inp -0.03306937253920 OK ( 6.11 sec) crys_per_qmmm_spln.inp -0.03306936689225 OK ( 6.56 sec) crys_per_qmmm_none.inp -0.08375440741158 OK ( 4.00 sec) acn-qmmm-re.inp -14.78512402428111 OK ( 2.69 sec) acn-conn-1.inp -291.98859227600644 OK ( 11.81 sec) wat_nacl.inp -16.691503876245207 OK ( 7.27 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QMMM/QS/regtest-4 (18 of 45) done in 55.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QMMM/SE/regtest_2 (19 of 45) Running nh3_g4x6_excl_mm.inp Running nh3_g4x6_excl_qm.inp Running water_colv_excl_mm.inp Running water_colv_excl_qm.inp Running water_fixd_excl_mm.inp Running water_fixd_excl_qm.inp Running water_g3x3_excl_mm.inp Running water_g3x3_excl_qm.inp Running Si_tersoff_qmmm.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QMMM/SE/regtest_2 nh3_g4x6_excl_mm.inp -0.913069017786E+01 OK ( 3.27 sec) nh3_g4x6_excl_qm.inp -0.913127863162E+01 OK ( 3.83 sec) water_colv_excl_mm.inp -0.128071776255E+02 OK ( 2.97 sec) water_colv_excl_qm.inp -0.128078086386E+02 OK ( 3.70 sec) water_fixd_excl_mm.inp -0.128094856912E+02 OK ( 2.38 sec) water_fixd_excl_qm.inp -0.128087667071E+02 OK ( 3.92 sec) water_g3x3_excl_mm.inp -0.128057061878E+02 OK ( 2.99 sec) water_g3x3_excl_qm.inp -0.128090813557E+02 OK ( 3.56 sec) Si_tersoff_qmmm.inp -3418.06809308977336 OK ( 31.47 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QMMM/SE/regtest_2 (19 of 45) done in 72.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-mp2-1 (20 of 45) Running H2O-01.inp Running Li.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-mp2-1 H2O-01.inp -76.263035235006953 OK ( 19.05 sec) Li.inp -7.442887463667534 OK ( 21.80 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-mp2-1 (20 of 45) done in 44.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-gapw-2 (21 of 45) Running Li-ROKS.inp Running NO2-ROKS.inp Running C-levelshift.inp Running H2-pbe-restart-run.inp Running H2-pbe-restart-rerun.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-gapw-2 Li-ROKS.inp -7.33891040994158 OK ( 4.70 sec) NO2-ROKS.inp -203.77833570926850 OK ( 9.54 sec) C-levelshift.inp -37.44694658478038 OK ( 4.58 sec) H2-pbe-restart-run.inp -0.60698327541572 OK ( 14.98 sec) H2-pbe-restart-rerun.inp -0.60698327541578 OK ( 3.80 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-gapw-2 (21 of 45) done in 45.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QMMM/QS/regtest-2-erf (22 of 45) Running H2O-qmmm-gauss-14-geep-2.inp Running H2O-qmmm-gauss-14-geep-3.inp Running H2O-qmmm-gauss-14-geep-4.inp Running H2O-qmmm-gauss-14-geep-5.inp Running H2O-qmmm-gauss-14-geep-6.inp Running H2O-qmmm-gauss-14-geep-7.inp Running H2O-qmmm-gauss-14-geep-8.inp Running H2O-qmmm-gauss-14-geep-9.inp Running H2O-qmmm-gauss-14-geep-10.inp Running H2O-qmmm-gauss-14-geep-11.inp Running H2O-qmmm-gauss-14-geep-12.inp Running H2O-qmmm-gauss-14-geep-13.inp Running H2O-qmmm-gauss-14-geep-14.inp Running H2O-qmmm-gauss-14-geep-15.inp Running H2O-qmmm-gauss-14-geep-16.inp Running H2O-qmmm-gauss-14-geep-17.inp Running H2O-qmmm-gauss-14-geep-18.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QMMM/QS/regtest-2-erf H2O-qmmm-gauss-14-geep-2.inp -12.90417644796132 OK ( 0.80 sec) H2O-qmmm-gauss-14-geep-3.inp -12.90712061195513 OK ( 0.98 sec) H2O-qmmm-gauss-14-geep-4.inp -12.90733560861444 OK ( 0.68 sec) H2O-qmmm-gauss-14-geep-5.inp -12.92642686633616 OK ( 0.77 sec) H2O-qmmm-gauss-14-geep-6.inp -12.92230602229929 OK ( 0.96 sec) H2O-qmmm-gauss-14-geep-7.inp -12.91849696653134 OK ( 1.19 sec) H2O-qmmm-gauss-14-geep-8.inp -12.91621682584141 OK ( 0.73 sec) H2O-qmmm-gauss-14-geep-9.inp -12.91437166178051 OK ( 1.04 sec) H2O-qmmm-gauss-14-geep-10.inp -12.91328069125532 OK ( 0.62 sec) H2O-qmmm-gauss-14-geep-11.inp -12.91297474164520 OK ( 0.67 sec) H2O-qmmm-gauss-14-geep-12.inp -12.91332340554816 OK ( 1.02 sec) H2O-qmmm-gauss-14-geep-13.inp -12.91325023093018 OK ( 1.58 sec) H2O-qmmm-gauss-14-geep-14.inp -12.91299456138501 OK ( 1.03 sec) H2O-qmmm-gauss-14-geep-15.inp -12.91325018773295 OK ( 3.46 sec) H2O-qmmm-gauss-14-geep-16.inp -12.91325925146000 OK ( 3.59 sec) H2O-qmmm-gauss-14-geep-17.inp -12.91336718381622 OK ( 4.54 sec) H2O-qmmm-gauss-14-geep-18.inp -12.91336753630966 OK ( 5.29 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QMMM/QS/regtest-2-erf (22 of 45) done in 52.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-md-lgvregion (23 of 45) Running langevin_regions-1.inp Running langevin_regions-2.inp Running langevin_regions-3.inp Running langevin_regions-4.inp Running langevin_regions-5.inp Running langevin_regions-6.inp Running langevin_regions-7.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-md-lgvregion langevin_regions-1.inp -34.28350497030236 OK ( 6.60 sec) langevin_regions-2.inp -34.29678091854984 OK ( 7.08 sec) langevin_regions-3.inp -34.28350497030237 OK ( 7.56 sec) langevin_regions-4.inp -34.28727330165425 OK ( 5.86 sec) langevin_regions-5.inp -34.36743843099393 OK ( 7.72 sec) langevin_regions-6.inp -34.36335813031099 OK ( 12.12 sec) langevin_regions-7.inp -34.37404120268309 OK ( 8.77 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-md-lgvregion (23 of 45) done in 67.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-almo-eda (24 of 45) Running almo-eda-x.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-almo-eda almo-eda-x.inp -85.963743073053323 OK ( 45.24 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-almo-eda (24 of 45) done in 48.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-epr-2 (25 of 45) Running NO2-EPR-1.inp Running NO2-EPR-2.inp Running NO2-EPR-3.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-epr-2 NO2-EPR-1.inp -0.344563E-02 OK ( 31.61 sec) NO2-EPR-2.inp -0.252817E-02 OK ( 8.96 sec) NO2-EPR-3.inp -0.358602E-02 OK ( 12.57 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-epr-2 (25 of 45) done in 58.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-hybrid-1 (26 of 45) Running H2O-hybrid-bhandh.inp Running H2O-hybrid-bhandhlyp.inp Running H2O-hybrid-pbe0.inp Running H2O-hybrid-b3lyp.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-hybrid-1 H2O-hybrid-bhandh.inp -75.90482120088643 OK ( 7.38 sec) H2O-hybrid-bhandhlyp.inp -76.33558053104217 OK ( 7.54 sec) H2O-hybrid-pbe0.inp -76.31995335312716 OK ( 7.56 sec) H2O-hybrid-b3lyp.inp -76.37338940401892 OK ( 7.80 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-hybrid-1 (26 of 45) done in 37.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/FARMING/regtest-1 (27 of 45) Running farming-1.inp Running farming-2.inp Running farming-3.inp Running farming-4.inp Running farming-5.inp Running farming-6.inp Running farming-7.inp Running farming-8.inp Running farming-9.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/FARMING/regtest-1 farming-1.inp - OK ( 1.81 sec) farming-2.inp - OK ( 2.10 sec) farming-3.inp - OK ( 1.90 sec) farming-4.inp - OK ( 2.26 sec) farming-5.inp - OK ( 2.57 sec) farming-6.inp - OK ( 2.15 sec) farming-7.inp - OK ( 2.35 sec) farming-8.inp - OK ( 1.98 sec) farming-9.inp - OK ( 0.56 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/FARMING/regtest-1 (27 of 45) done in 29.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-ot-refine-3 (28 of 45) Running h2o_ot_lwdn_on_the_fly_l1.inp Running h2o_ot_poly_on_the_fly_l1.inp Running o2_ot_lwdn_on_the_fly_l1.inp Running o2_ot_poly_on_the_fly_l1.inp Running h2o_ot_refine_3.inp Running h2o_ot_refine_4.inp Running o2_ot_refine_3.inp Running o2_ot_refine_4.inp Running h2o_ot_precond_1.inp Running h2o_ot_precond_2.inp Running h2o_ot_precond_3.inp Running h2o_ot_precond_4.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-ot-refine-3 h2o_ot_lwdn_on_the_fly_l1.inp -17.13045715683766 OK ( 1.45 sec) h2o_ot_poly_on_the_fly_l1.inp -17.13045715683766 OK ( 1.61 sec) o2_ot_lwdn_on_the_fly_l1.inp -31.70815200232903 OK ( 3.10 sec) o2_ot_poly_on_the_fly_l1.inp -31.70815200232901 OK ( 2.65 sec) h2o_ot_refine_3.inp -17.08884672065215 OK ( 1.16 sec) h2o_ot_refine_4.inp -17.11857283464191 OK ( 0.94 sec) o2_ot_refine_3.inp -31.60858514413055 OK ( 1.59 sec) o2_ot_refine_4.inp -31.58768162895354 OK ( 1.47 sec) h2o_ot_precond_1.inp -16.05766867329450 OK ( 0.59 sec) h2o_ot_precond_2.inp -16.06790080254980 OK ( 0.45 sec) h2o_ot_precond_3.inp -16.02559849783376 OK ( 0.40 sec) h2o_ot_precond_4.inp -15.85782186391537 OK ( 0.58 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-ot-refine-3 (28 of 45) done in 32.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/Fist/regtest-11 (29 of 45) Running H2O-32_NVT_CSVR_gen1.inp Running H2O-32_NVT_CSVR_gen2.inp Running H2O-32_NVT_CSVR_gen3.inp Running H2O-32_NVT_NOSE_gen_noCNS0.inp Running H2O-32_NVT_CSVR_gen_noCNS1.inp Running H2O-32_NVT_CSVR_gen_noCNS1_R.inp Running H2O-32_NVT_CSVR_gen_noCNS2.inp Running H2O-32_NVT_CSVR_gen_noCNS2_R.inp Running H2O-32_NVT_NOSE_gen_noCNS1.inp Running H2O-32_NVT_NOSE_gen_noCNS1_R.inp Running H2O-32_NVT_NOSE_gen_noCNS2.inp Running H2O-32_NVT_NOSE_gen_noCNS2_R.inp Running H2O-32_NVT_CSVR_gen_noCNS3.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/Fist/regtest-11 H2O-32_NVT_CSVR_gen1.inp -0.609208076083E+00 OK ( 0.69 sec) H2O-32_NVT_CSVR_gen2.inp -0.532133592588E+00 OK ( 1.02 sec) H2O-32_NVT_CSVR_gen3.inp -0.500113893497E+00 OK ( 1.01 sec) H2O-32_NVT_NOSE_gen_noCNS0.inp -0.492823650978E+00 OK ( 0.83 sec) H2O-32_NVT_CSVR_gen_noCNS1.inp -0.509272888286E+00 OK ( 0.77 sec) H2O-32_NVT_CSVR_gen_noCNS1_R.inp -0.458244617541E+00 OK ( 0.68 sec) H2O-32_NVT_CSVR_gen_noCNS2.inp -0.505086327342E+00 OK ( 0.85 sec) H2O-32_NVT_CSVR_gen_noCNS2_R.inp -0.448996689945E+00 OK ( 0.95 sec) H2O-32_NVT_NOSE_gen_noCNS1.inp -0.495791635301E+00 OK ( 0.83 sec) H2O-32_NVT_NOSE_gen_noCNS1_R.inp -0.494111874054E+00 OK ( 0.84 sec) H2O-32_NVT_NOSE_gen_noCNS2.inp -0.484511068410E+00 OK ( 0.81 sec) H2O-32_NVT_NOSE_gen_noCNS2_R.inp -0.470407397710E+00 OK ( 0.88 sec) H2O-32_NVT_CSVR_gen_noCNS3.inp -0.505086327342E+00 OK ( 0.84 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/Fist/regtest-11 (29 of 45) done in 28.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-cdft-3-1 (30 of 45) Running HeH-noconstraint.inp Running HeH-cdft-state-1.inp Running HeH-cdft-state-2-reversed.inp Running HeH-mixed-cdft-reversed-1.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-cdft-3-1 HeH-noconstraint.inp -3.01067446615106 OK ( 7.75 sec) HeH-cdft-state-1.inp 0.048406444528 OK ( 8.66 sec) HeH-cdft-state-2-reversed.inp -1.819391902442 OK ( 9.55 sec) HeH-mixed-cdft-reversed-1.inp 616.641603572494 OK ( 2.03 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-cdft-3-1 (30 of 45) done in 34.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/NEB/regtest-1 (31 of 45) Running 2gly_B-NEB.inp Running 2gly_CI-NEB.inp Running 2gly_EB-NEB.inp Running 2gly_IT-NEB.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/NEB/regtest-1 2gly_B-NEB.inp -0.25722568775377 OK ( 3.49 sec) 2gly_CI-NEB.inp -0.18925537289822 OK ( 3.62 sec) 2gly_EB-NEB.inp 49.27319370383622 OK ( 3.46 sec) 2gly_IT-NEB.inp 0.38518828458623 OK ( 2.86 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/NEB/regtest-1 (31 of 45) done in 19.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-pao-3 (32 of 45) Running He_ref.inp Running He_pao_initguess_exp.inp Running He_pao_initguess_fock.inp Running He_pao_initguess_rotinv.inp Running He_pao_initguess_gth.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-pao-3 He_ref.inp -2.889334869153417 OK ( 3.38 sec) He_pao_initguess_exp.inp -2.888972913350860 OK ( 1.91 sec) He_pao_initguess_fock.inp -2.888972913350860 OK ( 1.86 sec) He_pao_initguess_rotinv.inp -2.888972913350860 OK ( 1.60 sec) He_pao_initguess_gth.inp -2.888972913350860 OK ( 1.72 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-pao-3 (32 of 45) done in 18.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/optimize_input/regtest-1 (33 of 45) Running argon-ref.inp Running driver.inp Running driver-restart.inp Running driver-stride.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/optimize_input/regtest-1 argon-ref.inp - OK ( 0.47 sec) driver.inp 0.1072347063760515E+03 OK ( 1.09 sec) driver-restart.inp 0.1076965059321592E+03 OK ( 2.52 sec) driver-stride.inp 0.1072343388958498E+03 OK ( 0.58 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/optimize_input/regtest-1 (33 of 45) done in 16.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-properties/resp (34 of 45) Running CH3OH_nonperiodic.inp Running CH3OH_periodic.inp Running graphite.inp Running CH3OH_periodic_repeat.inp Running graphite_REPEAT.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-properties/resp CH3OH_nonperiodic.inp 4.418290 OK ( 1.37 sec) CH3OH_periodic.inp 2.456029 OK ( 1.26 sec) graphite.inp -1.073313 OK ( 6.01 sec) CH3OH_periodic_repeat.inp -4.871712 OK ( 1.33 sec) graphite_REPEAT.inp 0.006058 OK ( 5.75 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-properties/resp (34 of 45) done in 23.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-nmr-2 (35 of 45) Running He_nmr_full.inp Running he2_bug_disp.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-nmr-2 He_nmr_full.inp 0.198893E+03 OK ( 17.78 sec) he2_bug_disp.inp 0.144732E+03 OK ( 5.52 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-nmr-2 (35 of 45) done in 27.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/SE/regtest-3-1 (36 of 45) Running H2O-MNDO-2.inp Running H-0.inp Running H2-0.inp Running H2.inp Running H2O-MNDO.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/SE/regtest-3-1 H2O-MNDO-2.inp -351.42145109555827 OK ( 0.97 sec) H-0.inp -0.319258384771667 OK ( 0.13 sec) H2-0.inp -0.993280881213762 OK ( 0.70 sec) H2.inp -0.037305167769230 OK ( 0.47 sec) H2O-MNDO.inp -12.913048351744974 OK ( 3.25 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/SE/regtest-3-1 (36 of 45) done in 13.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-optbas (37 of 45) Running H2O-ref.inp Running opt-1.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-optbas H2O-ref.inp -17.02896604845323 OK ( 5.67 sec) opt-1.inp -.46916008E+03 OK ( 13.35 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-optbas (37 of 45) done in 23.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-linearscaling (38 of 45) Running test-shrt.inp Running w3-filter.inp Running w3-filter-2.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-linearscaling test-shrt.inp - OK ( 1.87 sec) w3-filter.inp -51.14051793253617 OK ( 3.81 sec) w3-filter-2.inp -78.30555080313484 OK ( 1.29 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-linearscaling (38 of 45) done in 12.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/SWARM/regtest-glbopt-1 (39 of 45) Running LJ10_minhop_1.inp Running LJ10_minhop_2.inp Running LJ10_mincrawl_1.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/SWARM/regtest-glbopt-1 LJ10_minhop_1.inp -0.26595092E-01 OK ( 1.66 sec) LJ10_minhop_2.inp -0.28422123E-01 OK ( 0.93 sec) LJ10_mincrawl_1.inp -0.28422113E-01 OK ( 10.48 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/SWARM/regtest-glbopt-1 (39 of 45) done in 18.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/TAMC/regtest (40 of 45) Running dimer.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/TAMC/regtest dimer.inp -31.336010780067205 OK ( 19.05 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/TAMC/regtest (40 of 45) done in 21.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-lsroks (41 of 45) Running O2.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-lsroks O2.inp -31.43642997434301 OK ( 8.57 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-lsroks (41 of 45) done in 11.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QMMM/QS/regtest-lrigpw (42 of 45) Running C11H24-qmmm-gauss-0-lrigpw.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QMMM/QS/regtest-lrigpw C11H24-qmmm-gauss-0-lrigpw.inp -28.00745026097207 OK ( 4.27 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QMMM/QS/regtest-lrigpw (42 of 45) done in 7.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/FE/regtest-2 (43 of 45) Running Solv_alch_chng.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/FE/regtest-2 Solv_alch_chng.inp -0.732003926645E+01 OK ( 9.64 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/FE/regtest-2 (43 of 45) done in 12.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-fftw (44 of 45) Running H2-big-1.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-fftw H2-big-1.inp -28.149134408983251 OK ( 6.90 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-fftw (44 of 45) done in 9.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-dm-ls-scf-4 (45 of 45) Running H2O-dft-ls-DEFAULTS.inp Running H2O-dft-ls-NEWTONSCHULZ.inp Running H2O-dft-ls-PROOT3.inp Running H2O-dft-ls-PROOT4.inp Running H2O-dft-ls-PROOT5.inp Running H2O-dft-ls-NEWTONSCHULZ3.inp Running H2O-dft-ls-NEWTONSCHULZ4.inp Running H2O-dft-ls-NEWTONSCHULZ5.inp Running H2O-dft-ls-NEWTONSCHULZ6.inp Running H2O-dft-ls-NEWTONSCHULZ7.inp Running H2O-dft-ls-NEWTONSCHULZ-SYMMETRIC.inp Running H2O-dft-ls-SUBMATRIX-NS.inp Running H2O-dft-ls-SUBMATRIX-NS3.inp Running H2O-dft-ls-SUBMATRIX-DIRECT.inp Running H2O-dft-ls-SUBMATRIX-DIRECT-MUADJ.inp Running H2O-dft-ls-SUBMATRIX-DIRECT-MUADJ-LOWMEM.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-dm-ls-scf-4 H2O-dft-ls-DEFAULTS.inp -17.031737705910469 OK ( 1.65 sec) H2O-dft-ls-NEWTONSCHULZ.inp -17.031737705910469 OK ( 2.11 sec) H2O-dft-ls-PROOT3.inp -17.031737715858107 OK ( 1.98 sec) H2O-dft-ls-PROOT4.inp -17.031737702676047 OK ( 1.86 sec) H2O-dft-ls-PROOT5.inp -17.031737600350329 OK ( 2.20 sec) H2O-dft-ls-NEWTONSCHULZ3.inp -17.031737706154345 OK ( 2.00 sec) H2O-dft-ls-NEWTONSCHULZ4.inp -17.031737706154345 OK ( 1.88 sec) H2O-dft-ls-NEWTONSCHULZ5.inp -17.031737706154345 OK ( 1.78 sec) H2O-dft-ls-NEWTONSCHULZ6.inp -17.031737706154274 OK ( 2.20 sec) H2O-dft-ls-NEWTONSCHULZ7.inp -17.031737706160783 OK ( 2.30 sec) H2O-dft-ls-NEWTONSCHULZ-SYMMETRIC.inp -17.031737705910469 OK ( 1.93 sec) H2O-dft-ls-SUBMATRIX-NS.inp -17.031737705910469 OK ( 1.80 sec) H2O-dft-ls-SUBMATRIX-NS3.inp -17.031737706154345 OK ( 2.21 sec) H2O-dft-ls-SUBMATRIX-DIRECT.inp -17.031737706154345 OK ( 2.05 sec) H2O-dft-ls-SUBMATRIX-DIRECT-MUADJ.inp -17.031737706154356 OK ( 2.20 sec) H2O-dft-ls-SUBMATRIX-DIRECT-MUADJ-LOWMEM.inp -17.031737706154352 OK ( 2.03 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/tests/QS/regtest-dm-ls-scf-4 (45 of 45) done in 54.00 sec -------------------------------------------------------------------------- -------------------------------------------------------------------------- regtesting location summary file: /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/summary.txt regtesting location error_summary file: /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/error_summary regtesting location memory_summary file: /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33/memory_summary regtesting location output dir: /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-18_22-53-33 regtesting location last dir: /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//LAST-Linux-x86_64-gfortran-psmp --------------------------------- Timings -------------------------------- Plot: name="timings", title="Timing Distribution", ylabel="time [s]" PlotPoint: name="100th_percentile", plot="timings", label="100th %ile", y=116.5, yerr=0.0 PlotPoint: name="99th_percentile", plot="timings", label="99th %ile", y=71.79519999999961, yerr=0.0 PlotPoint: name="98th_percentile", plot="timings", label="98th %ile", y=53.706800000000015, yerr=0.0 PlotPoint: name="95th_percentile", plot="timings", label="95th %ile", y=36.236999999999995, yerr=0.0 PlotPoint: name="90th_percentile", plot="timings", label="90th %ile", y=24.222000000000037, yerr=0.0 PlotPoint: name="80th_percentile", plot="timings", label="80th %ile", y=11.254000000000005, yerr=0.0 --------------------------------- Summary -------------------------------- Number of FAILED tests 0 Number of WRONG tests 0 Number of CORRECT tests 367 Total number of tests 367 GREPME 0 0 367 0 367 X Summary: correct: 367 / 367; 58min Status: OK -------------------------------------------------------------------------- Regtest took 3506.00 seconds. -------------------------------------------------------------------------- Mon Oct 18 23:51:59 UTC 2021 *************************** testing ended ******************************** make[1]: Leaving directory '/build/cp2k-Q381vr/cp2k-8.1' create-stamp debian/debhelper-build-stamp dh_prep -i dh_installdirs -i dh_auto_install -i make -j4 install DESTDIR=/build/cp2k-Q381vr/cp2k-8.1/debian/tmp AM_UPDATE_INFO_DIR=no make[1]: Entering directory '/build/cp2k-Q381vr/cp2k-8.1' Discovering programs ... Makefile:280: target 'install' does not exist echo "" echo "The CP2K executable is /build/cp2k-Q381vr/cp2k-8.1/exe/local/cp2k.ssmp" The CP2K executable is /build/cp2k-Q381vr/cp2k-8.1/exe/local/cp2k.ssmp echo "" make[1]: Leaving directory '/build/cp2k-Q381vr/cp2k-8.1' dh_install -i dh_installdocs -i dh_installchangelogs -i dh_installexamples -i dh_perl -i dh_link -i dh_strip_nondeterminism -i dh_compress -i dh_fixperms -i dh_missing -i dh_installdeb -i dh_gencontrol -i dpkg-gencontrol: warning: Depends field of package cp2k-data: substitution variable ${shlibs:Depends} used, but is not defined dh_md5sums -i dh_builddeb -i dpkg-deb: building package 'cp2k-data' in '../cp2k-data_8.1-9_all.deb'. dpkg-genbuildinfo --build=all dpkg-genchanges --build=all >../cp2k_8.1-9_all.changes dpkg-genchanges: info: binary-only arch-indep upload (source code and arch-specific packages not included) dpkg-source --after-build . dpkg-buildpackage: info: binary-only upload (no source included) I: running special hook: sync-out /build/cp2k-Q381vr /tmp/cp2k-8.1-9wpohlici I: cleaning package lists and apt cache... W: deleting files in /tmp: hsperfdata_builduser W: deleting files in /tmp: hsperfdata_root I: creating tarball... I: done I: removing tempdir /tmp/mmdebstrap.nzJUYPQ2Hj... I: success in 9722.1782 seconds md5: Value of 'md5' differs for cp2k-data_8.1-9_all.deb md5: Size differs for cp2k-data_8.1-9_all.deb sha1: Value of 'sha1' differs for cp2k-data_8.1-9_all.deb sha1: Size differs for cp2k-data_8.1-9_all.deb sha256: Value of 'sha256' differs for cp2k-data_8.1-9_all.deb sha256: Size differs for cp2k-data_8.1-9_all.deb Checksums: FAIL diffoscope run passed