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-8.1-94y6hgvsu/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-8.1-94y6hgvsu 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.6uujaFFThY 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.6uujaFFThY 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 (606 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.6uujaFFThY 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 19s (1174 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.6uujaFFThY 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.6uujaFFThY 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 2s (1283 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.6uujaFFThY 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/task_list_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/core_ae.F 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/build/cp2k-Q381vr/cp2k-8.1/src/shg_int/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/minimax/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/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 ./task_list_methods.F ./core_ae.F ./qs_fb_trial_fns_types.F ./mdctrl_types.F ./hfx_ri.F ./qs_scf_methods.F ./negf_methods.F ./qs_tddfpt2_types.F ./cp_ddapc_types.F ./mixed_energy_types.F ./kpoint_types.F ./qs_rho0_types.F ./qs_resp.F ./qs_commutators.F ./qs_ot_eigensolver.F ./qs_update_s_mstruct.F ./hfx_pw_methods.F ./qmmm_elpot.F ./qs_overlap.F ./qs_loc_types.F ./qs_o3c_types.F ./kg_environment.F ./farming_methods.F ./negf_green_methods.F ./preconditioner_types.F ./constraint_4x6.F ./qs_scf_types.F ./splines_types.F ./qs_fb_com_tasks_types.F ./optbas_opt_utils.F ./lri_environment_init.F ./qmmm_se_energy.F ./mao_wfn_analysis.F ./cp_external_control.F ./swarm/swarm_master.F ./swarm/swarm_input.F ./swarm/glbopt_minhop.F ./swarm/glbopt_master.F ./swarm/glbopt_mincrawl.F ./swarm/glbopt_worker.F ./swarm/swarm.F ./swarm/swarm_message.F ./swarm/glbopt_history.F ./swarm/swarm_mpi.F ./swarm/swarm_worker.F ./swarm/glbopt_input.F ./constraint_fxd.F ./qs_energy.F ./qs_tddfpt2_subgroups.F ./fist_neighbor_list_control.F ./csvr_system_types.F ./nnp_model.F ./replica_methods.F ./tmc/tmc_utils.F ./tmc/tmc_tree_types.F ./tmc/tmc_messages.F ./tmc/tmc_calculations.F ./tmc/tmc_setup.F ./tmc/tmc_analysis_types.F ./tmc/tmc_worker.F ./tmc/tmc_types.F ./tmc/tmc_tree_search.F ./tmc/tmc_move_types.F ./tmc/tmc_cancelation.F ./tmc/tmc_master.F ./tmc/tmc_move_handle.F ./tmc/tmc_stati.F ./tmc/tmc_file_io.F ./tmc/tmc_moves.F ./tmc/tmc_dot_tree.F ./tmc/tmc_analysis.F ./tmc/tmc_tree_references.F ./tmc/tmc_tree_build.F ./tmc/tmc_tree_acceptance.F ./tmc/input_cp2k_tmc.F ./group_dist_types.F ./qmmmx_util.F ./motion/cp_lbfgs_optimizer_gopt.F ./motion/helium_interactions.F ./motion/input_cp2k_restarts.F ./motion/neb_types.F ./motion/md_util.F ./motion/glbopt_callback.F ./motion/thermal_region_types.F ./motion/md_environment_types.F ./motion/pint_public.F ./motion/pint_methods.F ./motion/pint_pile.F ./motion/dumpdcd.F ./motion/thermal_region_utils.F ./motion/pint_types.F ./motion/helium_sampling.F ./motion/dimer_utils.F ./motion/bfgs_optimizer.F ./motion/md_run.F ./motion/cg_optimizer.F ./motion/neb_utils.F ./motion/cell_opt.F ./motion/reftraj_types.F ./motion/reftraj_util.F ./motion/neb_methods.F ./motion/pint_qtb.F ./motion/thermostat/al_system_init.F ./motion/thermostat/extended_system_dynamics.F ./motion/thermostat/barostat_types.F ./motion/thermostat/al_system_dynamics.F ./motion/thermostat/thermostat_types.F ./motion/thermostat/extended_system_mapping.F ./motion/thermostat/input_cp2k_barostats.F ./motion/thermostat/csvr_system_dynamics.F ./motion/thermostat/barostat_utils.F ./motion/thermostat/gle_system_dynamics.F ./motion/thermostat/csvr_system_mapping.F ./motion/thermostat/al_system_mapping.F ./motion/thermostat/csvr_system_init.F ./motion/thermostat/thermostat_methods.F ./motion/thermostat/thermostat_mapping.F ./motion/thermostat/thermostat_utils.F ./motion/thermostat/extended_system_init.F ./motion/dimer_types.F ./motion/wiener_process.F ./motion/helium_methods.F ./motion/rt_propagation.F ./motion/integrator.F ./motion/cell_opt_utils.F ./motion/averages_types.F ./motion/neb_io.F ./motion/cp_lbfgs_geo.F ./motion/simpar_methods.F ./motion/gopt_f_types.F ./motion/velocity_verlet_control.F ./motion/gopt_f77_methods.F ./motion/helium_worm.F ./motion/input_cp2k_md.F ./motion/md_ener_types.F ./motion/mc/mc_types.F ./motion/mc/mc_moves.F ./motion/mc/mc_coordinates.F ./motion/mc/mc_misc.F ./motion/mc/mc_ge_moves.F ./motion/mc/mc_run.F ./motion/mc/mc_ensembles.F ./motion/mc/mc_environment_types.F ./motion/mc/mc_move_control.F ./motion/mc/mc_control.F ./motion/mc/tamc_run.F ./motion/cg_utils.F ./motion/shell_opt.F ./motion/cell_opt_types.F ./motion/pint_transformations.F ./motion/neb_md_utils.F ./motion/integrator_utils.F ./motion/md_energies.F ./motion/pint_piglet.F ./motion/pint_io.F ./motion/geo_opt.F ./motion/gopt_f_methods.F ./motion/gopt_param_types.F ./motion/cp_lbfgs.F ./motion/neb_opt_utils.F ./motion/helium_types.F ./motion/vibrational_analysis.F ./motion/xyz2dcd.F ./motion/helium_common.F ./motion/input_cp2k_vib.F ./motion/md_vel_utils.F ./motion/free_energy_methods.F ./motion/pint_normalmode.F ./motion/helium_io.F ./motion/pint_gle.F ./motion/mdctrl_methods.F ./motion/dimer_methods.F ./motion/md_conserved_quantities.F ./motion/pint_staging.F ./hfx_pair_list_methods.F ./input_cp2k_global.F ./qs_scf_post_gpw.F ./pao_methods.F ./xc/xc_tpss.F ./xc/xc_lyp_adiabatic.F ./xc/xc_xbecke88.F ./xc/xc_pbe.F ./xc/xc_optx.F ./xc/cp_linked_list_xc_deriv.F ./xc/xc_libxc_wrap.F ./xc/xc_sr_lda.F ./xc/xc_xlda_hole_t_c_lr.F ./xc/xc_xbeef.F ./xc/xc_ke_gga.F ./xc/xc_thomas_fermi.F ./xc/xc_functionals_utilities.F ./xc/xc_libxc.F ./xc/xc_pade.F ./xc/xc_xbecke88_lr_adiabatic.F ./xc/xc_tfw.F ./xc/xc_xalpha.F ./xc/xc_rho_cflags_types.F ./xc/xc_derivative_set_types.F ./xc/xc_derivative_types.F ./xc/xc.F ./xc/xc_xwpbe.F ./xc/xc_xbecke88_long_range.F ./xc/xc_vwn.F ./xc/xc_b97.F ./xc/xc_hcth.F ./xc/xc_cs1.F ./xc/xc_xbr_pbe_lda_hole_t_c_lr.F ./xc/xc_rho_set_types.F ./xc/xc_xbecke_roussel.F ./xc/xc_exchange_gga.F ./xc/xc_perdew86.F ./xc/xc_lyp.F ./xc/xc_perdew_wang.F ./xc/xc_atom.F ./xc/xc_derivatives.F ./xc/xc_xpbe_hole_t_c_lr.F ./xc/xc_perdew_zunger.F ./xc/xc_derivative_desc.F ./xc/xc_input_constants.F ./dm_ls_scf_create.F ./al_system_types.F ./qs_tddfpt2_stda_utils.F ./input_cp2k_embed.F ./se_fock_matrix_exchange.F ./ec_efield_local.F ./mp2.F ./rpa_main.F ./rt_propagation_forces.F ./qs_mo_occupation.F ./rpa_gw.F ./pexsi_types.F ./graphcon.F ./cp_dbcsr_output.F ./auto_basis.F ./qs_ks_apply_restraints.F ./qs_ot.F ./sirius_interface.F ./cp_realspace_grid_init.F ./qs_loc_utils.F ./semi_empirical_integrals.F ./optimize_basis_types.F ./qs_diis_types.F ./library_tests.F ./qs_scf_csr_write.F ./cp_subsys_methods.F ./atom_kind_orbitals.F ./molecular_states.F ./f77_interface.F ./force_fields_util.F ./qs_block_davidson_types.F ./uff_vdw_radii_table.F ./optimize_input.F ./qs_ot_types.F ./se_core_matrix.F ./qs_environment.F ./input_cp2k_qmmm.F ./arnoldi/arnoldi_geev.F ./arnoldi/arnoldi_types.F ./arnoldi/arnoldi_methods.F ./arnoldi/arnoldi_api.F ./arnoldi/arnoldi_data_methods.F ./rpa_gw_im_time_util.F ./qs_interactions.F ./mp2_optimize_ri_basis.F ./dft_plus_u.F ./rpa_rse.F ./mscfg_methods.F ./common/cp_array_sort.F ./common/whittaker.F ./common/reference_manager.F ./common/string_table.F ./common/cuda_profiling.F ./common/bibliography.F ./common/powell.F ./common/cp_result_types.F ./common/cp_files.F ./common/structure_factors.F ./common/cg_test.F ./common/list_routinestat.F ./common/physcon.F ./common/lapack.F ./common/routine_map.F ./common/cp_result_methods.F ./common/timings_base_type.F ./common/util.F ./common/print_messages.F ./common/t_sh_p_s_c.F ./common/string_utilities.F ./common/timings.F ./common/linear_systems.F ./common/d3_poly.F ./common/list_timerenv.F ./common/spherical_harmonics.F ./common/lebedev.F ./common/cp_units.F ./common/mathconstants.F ./common/mathlib.F ./common/timings_types.F ./common/periodic_table.F ./common/list.F ./common/cp_para_types.F ./common/cp_error_handling.F ./common/bessel_lib.F ./common/cp_para_env.F ./common/parallel_rng_types_unittest.F ./common/fparser.F ./common/gamma.F ./common/cp_iter_types.F ./common/callgraph.F ./common/eigenvalueproblems.F ./common/list_routinereport.F ./common/splines.F ./common/list_callstackentry.F ./common/memory_utilities.F ./common/t_c_g0.F ./common/distribution_1d_types.F ./common/cp_log_handling.F ./common/cp_array_utils.F ./common/structure_factor_types.F ./common/parallel_rng_types.F ./common/timings_report.F ./common/memory_utilities_unittest.F ./common/kahan_sum.F ./common/cp_min_heap.F ./force_env_methods.F ./csvr_system_utils.F ./fist_main.F ./qs_dispersion_types.F ./input_cp2k_check.F ./qmmm_force.F ./lri_environment_types.F ./qs_density_mixing_types.F ./fist_efield_types.F ./qs_linres_epr_ownutils.F ./linesearch.F ./mp2_eri_gpw.F ./qmmm_topology_util.F ./pexsi_interface.F ./xc_adiabatic_methods.F ./pao_param_gth.F ./atom_xc.F ./topology_xyz.F ./input_cp2k_distribution.F ./qs_elf_methods.F ./qs_kpp1_env_methods.F ./qs_rho_atom_methods.F ./libint_2c_3c.F ./qs_moments.F ./mp2_ri_grad.F ./negf_control_types.F ./paw_proj_set_types.F ./global_types.F ./transport_env_types.F ./ct_methods.F ./dm_ls_scf_methods.F ./embed_main.F ./atom_basis.F ./wannier_states_types.F ./almo_scf_lbfgs_types.F ./qs_cdft_scf_utils.F ./qs_harmonics_atom.F ./rmsd.F ./qs_chargemol.F ./mp2_laplace.F ./ec_env_types.F ./qs_fb_hash_table_types.F ./nnp_environment_types.F ./nnp_acsf.F ./cp_dbcsr_cp2k_link.F ./xas_methods.F ./pair_potential_coulomb.F ./qs_active_space_methods.F ./qs_gcp_utils.F ./qs_fb_matrix_data_types.F ./qmmm_gaussian_input.F ./kpoint_methods.F ./ewalds.F ./et_coupling_types.F ./cp2k_info.F ./qs_kpp1_env_types.F ./qs_subsys_types.F ./constraint_3x3.F ./mixed_environment.F ./qs_external_density.F ./submatrix_types.F ./rpa_gw_kpoints.F ./pao_ml.F ./almo_scf.F ./negf_green_cache.F ./manybody_gal.F ./et_coupling.F ./topology_amber.F ./molecular_moments.F ./input_cp2k_ls.F ./block_p_types.F ./atom_sgp.F ./minbas_methods.F ./input_cp2k_loc.F ./qs_scf_initialization.F ./pwdft_environment_types.F ./ewald_environment_types.F ./qs_linres_current_utils.F ./atom_utils.F ./force_fields_input.F ./qs_wf_history_methods.F ./lri_environment_methods.F ./qs_o3c_methods.F ./fist_environment_types.F ./qs_ks_qmmm_types.F ./base/machine_internal.F ./base/base_hooks.F ./base/machine.F ./base/kinds.F ./mp2_ri_gpw.F ./qs_linres_types.F ./kg_correction.F ./atomic_charges.F ./lri_integrals.F ./xas_tdp_integrals.F ./qmmm_pw_grid.F ./semi_empirical_mpole_types.F ./cp_dbcsr_cholesky.F ./qs_epr_hyp.F ./submatrix_dissection.F ./rpa_axk.F ./qs_matrix_pools.F ./qs_kind_types.F ./minbas_wfn_analysis.F ./cp_ddapc_forces.F ./domain_submatrix_types.F ./input_cp2k_eip.F ./localization_tb.F ./qs_wannier90.F ./lri_forces.F ./xtb_parameters.F ./emd/rt_delta_pulse.F ./emd/rt_propagation_output.F ./emd/rt_hfx_utils.F ./emd/rt_propagator_init.F ./emd/rt_propagation_methods.F ./emd/rt_propagation_utils.F ./emd/rt_make_propagators.F ./topology_pdb.F ./cp_ddapc_methods.F ./input_cp2k_motion_print.F ./cp_dbcsr_diag.F ./qs_tddfpt2_fhxc.F ./hfx_screening_methods.F ./qs_localization_methods.F ./topology_gromos.F ./topology_cp2k.F ./splines_methods.F ./admm_types.F ./qs_charge_mixing.F ./dm_ls_scf.F ./population_analyses.F ./qs_dftb_types.F ./gle_system_types.F ./kpoint_transitional.F ./qs_core_hamiltonian.F ./constraint.F ./transport.F ./input/cp_parser_inpp_types.F ./input/input_parsing.F ./input/input_section_types.F ./input/cp_output_handling.F ./input/input_keyword_types.F ./input/cp_parser_methods.F ./input/cp_parser_inpp_methods.F ./input/cp_parser_ilist_methods.F ./input/cp_parser_status_types.F ./input/input_enumeration_types.F ./input/cp_parser_types.F ./input/cp_parser_buffer_types.F ./input/input_val_types.F ./input/cp_linked_list_input.F ./input/cp_parser_ilist_types.F ./distribution_methods.F ./input_cp2k_subsys.F ./qs_integrate_potential_single.F ./input_cp2k_binary_restarts.F ./bsse.F ./rel_control_types.F ./qs_scf.F ./qs_scf_post_tb.F ./fist_nonbond_force.F ./almo_scf_methods.F ./qs_dftb3_methods.F ./hfx_energy_potential.F ./semi_empirical_utils.F ./mpiwrap/message_passing.F ./force_field_types.F ./qmmmx_force.F ./manybody_tersoff.F ./manybody_quip.F ./negf_integr_utils.F ./qs_ot_scf.F ./fist_force.F ./matrix_exp.F ./mixed_environment_types.F ./xtb_ehess.F ./statistical_methods.F ./qs_dftb_coulomb.F ./ri_environment_methods.F ./topology_util.F ./topology_input.F ./qs_environment_methods.F ./input_cp2k_kpoints.F ./nnp_environment.F ./qmmm_gaussian_types.F ./free_energy_types.F ./atom_types.F ./input_cp2k_dft.F ./qs_energy_init.F ./qs_rho0_methods.F ./rpa_communication.F ./qs_linres_nmr_utils.F ./qs_ot_minimizer.F ./qs_tddfpt_utils.F ./atom_admm_methods.F ./response_solver.F ./almo_scf_env_methods.F ./cp_ddapc.F ./cp_gemm_interface.F ./fist_pol_scf.F ./dm_ls_chebyshev.F ./qs_linres_methods.F ./input_cp2k_restarts_util.F ./semi_empirical_int_gks.F ./optimize_basis_utils.F ./mp2_gpw_method.F ./xtb_types.F ./qs_dispersion_utils.F ./header.F ./input_optimize_basis.F ./mol_force.F ./rpa_im_time.F ./input_optimize_input.F ./iterate_matrix.F ./qs_oce_types.F ./qs_cdft_opt_types.F ./se_fock_matrix_integrals.F ./qmmmx_update.F ./preconditioner_apply.F ./surface_dipole.F ./mp2_gpw.F ./sap_kind_types.F ./mao_types.F ./pao_ml_neuralnet.F ./pair_potential_types.F ./efield_tb_methods.F ./preconditioner.F ./force_env_utils.F ./qs_ks_atom.F ./qs_electric_field_gradient.F ./qs_pdos.F ./cp2k_debug.F ./optbas_fenv_manipulation.F ./atom_energy.F ./topology_generate_util.F ./qs_core_energies.F ./commutator_rpnl.F ./constraint_util.F ./qs_sccs.F ./xc_write_output.F ./negf_vectors.F ./qs_integral_utils.F ./negf_subgroup_types.F ./hfx_derivatives.F ./atom_upf.F ./hirshfeld_types.F ./lri_optimize_ri_basis_types.F ./external_potential_methods.F ./mp2_ri_grad_util.F ./qs_neighbor_lists.F ./colvar_methods.F ./qmmm_image_charge.F ./xas_tdp_types.F ./dkh_main.F ./et_coupling_proj.F ./wannier_states.F ./qs_active_space_types.F ./qs_tddfpt2_operators.F ./negf_env_types.F ./pao_linpot_rotinv.F ./input_cp2k_colvar.F ./atom_operators.F ./atoms_input.F ./input_cp2k_almo.F ./pao_main.F ./xc_pot_saop.F ./qs_ks_qmmm_methods.F ./qs_rho_methods.F ./qs_energy_window.F ./rpa_gw_ic.F ./qmmm_create.F ./qs_tensors_types.F ./qmmm_links_methods.F ./force_env_types.F ./semi_empirical_expns3_types.F ./qmmm_gaussian_data.F ./qs_tddfpt_eigensolver.F ./qmmm_types.F ./pao_param.F ./basis_set_output.F ./lri_ks_methods.F ./motion_utils.F ./metadyn_tools/graph_methods.F ./metadyn_tools/graph_utils.F ./metadyn_tools/graph.F ./cp_control_utils.F ./semi_empirical_int3_utils.F ./qs_wf_history_types.F ./qs_cdft_types.F ./qs_fb_input.F ./qs_scf_post_scf.F ./qs_fb_distribution_methods.F ./qmmm_se_forces.F ./qs_dos.F ./atom_fit.F ./atom_pseudo.F ./qmmm_gpw_forces.F ./qs_external_potential.F ./atom_grb.F ./qs_initial_guess.F ./pilaenv_hack.F ./molsym.F ./optimize_basis.F ./qs_tddfpt2_methods.F ./dm_ls_scf_qs.F ./metadynamics_utils.F ./qs_scf_loop_utils.F ./fist_nonbond_env_types.F ./semi_empirical_int_ana.F ./eip_silicon.F ./qs_gcp_method.F ./input_cp2k_mixed.F ./exclusion_types.F ./xas_tdp_correction.F ./mp2_integrals.F ./qs_elec_field.F ./xtb_coulomb.F ./task_list_types.F ./efield_utils.F ./qs_environment_types.F ./qs_tddfpt_types.F ./fp_types.F ./input_cp2k_rsgrid.F ./almo_scf_qs.F ./pme_tools.F ./qs_rho_atom_types.F ./mp2_grids.F ./pw_env_methods.F ./mulliken.F ./libint_wrapper.F ./qs_p_env_types.F ./mp2_cphf.F ./qmmm_tb_coulomb.F ./cp_realspace_grid_cube.F ./semi_empirical_int_num.F ./hartree_local_methods.F ./ewald_pw_types.F ./input_cp2k_neb.F ./fp_methods.F ./se_fock_matrix.F ./ct_types.F ./negf_atom_map.F ./simpar_types.F ./input_cp2k_tb.F ./mode_selective.F ./cp_dbcsr_operations.F ./qs_integrate_potential_product.F ./semi_empirical_types.F ./mp2_ri_2c.F ./topology_constraint_util.F ./qs_period_efield_types.F ./molden_utils.F ./se_core_core.F ./s_square_methods.F ./cp_eri_mme_interface.F ./qs_tddfpt2_eigensolver.F ./qs_nl_hash_table_types.F ./qs_dispersion_pairpot.F ./stm_images.F ./integration_grid_types.F ./qmmm_init.F ./qs_scf_lanczos.F ./dm_ls_scf_curvy.F ./subcell_types.F ./dbcsrx/dbcsr_vector.F ./kpoint_coulomb_2c.F ./hfx_load_balance_methods.F ./pw_env/gaussian_gridlevels.F ./pw_env/cp_spline_utils.F ./pw_env/pw_env_types.F ./pw_env/rs_pw_interface.F ./beta_gamma_psi.F ./lri_compression.F ./qs_fb_env_methods.F ./pw_poisson_read_input.F ./xas_control.F ./almo_scf_types.F ./topology_connectivity_util.F ./voronoi_interface.F ./hfx_communication.F ./wannier90.F ./qs_vxc.F ./pao_linpot_full.F ./hfx_libint_interface.F ./qs_tddfpt_module.F ./qs_linres_current.F ./commutator_rkinetic.F ./input_cp2k_transport.F ./grid/grid_api.F ./hfx_admm_utils.F ./negf_integr_cc.F ./qs_tddfpt2_utils.F ./hfx_compression_methods.F ./optimize_embedding_potential.F ./manybody_siepmann.F ./eri_mme/eri_mme_types.F ./eri_mme/eri_mme_gaussian.F ./eri_mme/eri_mme_lattice_summation.F ./eri_mme/eri_mme_test.F ./eri_mme/eri_mme_integrate.F ./eri_mme/eri_mme_util.F ./eri_mme/eri_mme_error_control.F ./mixed_cdft_utils.F ./qs_linres_issc_utils.F ./qs_fb_buffer_types.F ./constraint_vsite.F ./qs_collocate_density.F ./input_restart_force_eval.F ./mixed_environment_utils.F ./qs_ks_utils.F ./domain_submatrix_methods.F ./input_cp2k_atom.F ./qs_loc_states.F ./input_cp2k_ec.F ./qs_linres_epr_utils.F ./input_cp2k_atprop.F ./preconditioner_solvers.F ./mp2_types.F ./pao_param_exp.F ./hfxbase/hfx_compression_core_methods.F ./hfxbase/hfx_contraction_methods.F ./hfxbase/hfx_contract_block.F ./negf_alloc_types.F ./pme.F ./input_cp2k_mp2.F ./rt_propagation_types.F ./scine_utils.F ./xas_restart.F ./pao_ml_gaussprocess.F ./pao_optimizer.F ./input_cp2k_poisson.F ./spme.F ./input_cp2k_mm.F ./core_ppl.F ./admm_dm_types.F ./qs_linres_epr_nablavks.F ./qs_fermi_contact.F ./input_cp2k_properties_dft.F ./input_cp2k_thermostats.F ./qmmm_per_elpot.F ./qs_vxc_atom.F ./qs_tddfpt2_densities.F ./energy_corrections.F ./qs_cdft_methods.F ./start/cp2k_runs.F ./start/libcp2k.F ./start/cp2k_shell.F ./start/input_cp2k_motion.F ./start/cp2k.F ./start/input_cp2k.F ./force_fields.F ./input_constants.F ./core_ppnl.F ./qs_gamma2kp.F ./hirshfeld_methods.F ./ipi_driver.F ./mp2_direct_method.F ./xas_tdp_utils.F ./hartree_local_types.F ./mscfg_types.F ./fm/cp_blacs_env.F ./fm/cp_blacs_calls.F ./fm/cp_fm_diag_utils.F ./fm/cp_fm_vect.F ./fm/cp_fm_struct.F ./fm/cp_linked_list_fm.F ./fm/cp_fm_types.F ./fm/cp_cfm_basic_linalg.F ./fm/cp_fm_pool_types.F ./fm/cp_fm_basic_linalg.F ./fm/cp_fm_elpa.F ./fm/cp_fm_diag.F ./fm/cp_fm_cholesky.F ./fm/cp_cfm_diag.F ./fm/cp_cfm_types.F ./qs_linres_op.F ./force_fields_all.F ./input_cp2k_nnp.F ./qs_mo_io.F ./kg_environment_types.F ./qs_dftb_utils.F ./xas_tp_scf.F ./qs_ks_methods.F ./hfx_helpers.F ./mao_basis.F ./qs_mom_types.F ./qs_efield_berry.F ./qs_scf_diagonalization.F ./qmmmx_types.F ./debug_os_integrals.F ./pao_io.F ./admm_dm_methods.F ./kg_tnadd_mat.F ./pair_potential.F ./semi_empirical_int_debug.F ./subsys/atomic_kind_types.F ./subsys/molecule_kind_list_types.F ./subsys/particle_types.F ./subsys/atomic_kind_list_types.F ./subsys/virial_types.F ./subsys/shell_potential_types.F ./subsys/external_potential_types.F ./subsys/cp_subsys_types.F ./subsys/force_field_kind_types.F ./subsys/molecule_types.F ./subsys/colvar_types.F ./subsys/cell_types.F ./subsys/damping_dipole_types.F ./subsys/molecule_list_types.F ./subsys/multipole_types.F ./subsys/atprop_types.F ./subsys/particle_list_types.F ./subsys/molecule_kind_types.F ./topology_psf.F ./kg_vertex_coloring_methods.F ./topology_cif.F ./qs_scf_output.F ./qs_linres_nmr_epr_common_utils.F ./cell_methods.F ./ewald_spline_util.F ./input_cp2k_constraints.F ./extended_system_types.F ./qs_condnum.F ./qs_outer_scf.F ./input_cp2k_resp.F ./qs_loc_dipole.F ./rtp_admm_methods.F ./atom_output.F ./xas_tdp_atom.F ./mm_mapping_library.F ./xc_adiabatic_utils.F ./qs_efield_local.F ./scf_control_types.F ./input_cp2k_field.F ./qs_diis.F ./qs_dispersion_nonloc.F ./qs_rho_types.F ./qs_gapw_densities.F ./embed_types.F ./pao_potentials.F ./rpa_util.F ./qs_local_rho_types.F ./qs_mo_types.F ./qs_integrate_potential.F ./pao_param_fock.F ./qs_oce_methods.F ./lri_optimize_ri_basis.F ./qs_mo_methods.F ./molecular_dipoles.F ./cp_symmetry.F ./qs_scf_post_se.F ./pao_ml_descriptor.F ./input_cp2k_external.F ./semi_empirical_expns3_methods.F ./qs_energy_matrix_w.F ./pw/lazy.F ./pw/pw_fpga.F ./pw/dirichlet_bc_types.F ./pw/pw_grid_types.F ./pw/ps_wavelet_fft3d.F ./pw/pw_pool_types.F ./pw/pw_types.F ./pw/fft/fftw3_lib.F ./pw/fft/fft_plan.F ./pw/fft/fft_kinds.F ./pw/fft/mltfftsg_tools.F ./pw/fft/fft_lib.F ./pw/fft/fftsg_lib.F ./pw/ps_wavelet_scaling_function.F ./pw/cp_linked_list_pw.F ./pw/pw_poisson_methods.F ./pw/ps_wavelet_kernel.F ./pw/ps_implicit_methods.F ./pw/mt_util.F ./pw/pw_spline_utils.F ./pw/dg_types.F ./pw/dielectric_methods.F ./pw/fft_tools.F ./pw/ps_wavelet_types.F ./pw/ps_wavelet_util.F ./pw/rs_methods.F ./pw/pw_grids.F ./pw/cube_utils.F ./pw/dct.F ./pw/realspace_grid_cube.F ./pw/fast.F ./pw/pw_poisson_types.F ./pw/dgs.F ./pw/dielectric_types.F ./pw/dirichlet_bc_methods.F ./pw/ps_wavelet_base.F ./pw/pw_methods.F ./pw/pw_cuda.F ./pw/realspace_grid_types.F ./pw/pw_grid_info.F ./pw/ps_implicit_types.F ./pw/ps_wavelet_methods.F ./pw/dg_rho0_types.F ./shg_int/generic_shg_integrals.F ./shg_int/s_contract_shg.F ./shg_int/generic_shg_integrals_init.F ./shg_int/constants_operator.F ./shg_int/construct_shg.F ./qs_fb_filter_matrix_methods.F ./qs_band_structure.F ./manybody_potential.F ./mp2_eri.F ./cp_control_types.F ./force_fields_ext.F ./qs_linres_polar_utils.F ./embed_environment.F ./pair_potential_util.F ./restraint.F ./farming_types.F ./qs_scf_wfn_mix.F ./environment.F ./taper_types.F ./mm_collocate_potential.F ./fist_neighbor_list_types.F ./mixed_cdft_types.F ./atom_electronic_structure.F ./ewald_methods_tb.F ./pao_types.F ./qs_linres_nmr_shift.F ./preconditioner_makes.F ./outer_scf_control_types.F ./shg_integrals_test.F ./colvar_utils.F ./se_fock_matrix_coulomb.F ./qs_dftb_matrices.F ./qs_dftb_parameters.F ./negf_integr_simpson.F ./mp2_setup.F ./minimax/minimax_exp_gw.F ./minimax/minimax_exp_k53.F ./minimax/minimax_rpa.F ./minimax/minimax_exp.F ./minimax/minimax_exp_k15.F ./almo_scf_optimizer.F ./topology_coordinate_util.F ./qmmm_types_low.F ./mao_optimizer.F ./qs_ks_types.F ./qs_rho0_ggrid.F ./qs_mom_methods.F ./qs_kinetic.F ./qmmm_gaussian_init.F ./grrm_utils.F ./virial_methods.F ./admm_utils.F ./ewald_pw_methods.F ./dm_ls_scf_types.F ./ewalds_multipole.F ./qs_force_types.F ./fist_energy_types.F ./qs_tensors.F ./input_cp2k_read.F ./fist_environment.F ./qs_hash_table_functions.F ./qs_gspace_mixing.F ./particle_methods.F ./input_cp2k_force_eval.F ./qs_operators_ao.F ./qs_charges_types.F ./eip_environment.F ./pwdft_environment.F ./fist_efield_methods.F ./qs_basis_gradient.F ./mixed_main.F ./nnp_force.F ./replica_types.F ./admm_methods.F ./xray_diffraction.F ./qmmmx_create.F ./cryssym.F ./qs_dftb_dispersion.F ./pexsi_methods.F ./qs_fb_atomic_matrix_methods.F ./qs_linres_atom_current.F ./moments_utils.F ./atom.F ./pao_param_linpot.F ./qs_neighbor_list_types.F ./semi_empirical_int_utils.F ./se_fock_matrix_dbg.F ./fermi_utils.F ./qmmm_ff_fist.F ./input_cp2k_hfx.F ./semi_empirical_parameters.F ./input_cp2k_free_energy.F ./fist_neighbor_lists.F ./semi_empirical_par_utils.F ./metadynamics.F ./input_restart_rng.F ./qs_subsys_methods.F ./ec_environment.F ./rpa_kpoints.F ./generic_os_integrals.F ./cp_ddapc_util.F ./qs_mixing_utils.F ./qs_local_properties.F ./qs_fb_atomic_halo_types.F ./qs_grid_atom.F ./xtb_matrices.F ./metadynamics_types.F ./qs_scf_block_davidson.F ./manybody_eam.F ./negf_matrix_utils.F ./qs_tddfpt2_restart.F ./atom_optimization.F ./qs_tddfpt2_properties.F ./qmmm_gpw_energy.F ./topology.F ./qs_cdft_utils.F ./optimize_dmfet_potential.F ./qs_tddfpt2_stda_types.F ./semi_empirical_store_int_types.F ./kpoint_io.F ./maxwell_solver_interface.F ./topology_types.F ./pao_input.F ./xas_tdp_methods.F ./ls_matrix_exp.F ./topology_multiple_unit_cell.F ./input_cp2k_negf.F ./qs_gcp_types.F ./qmmm_util.F ./semi_empirical_mpole_methods.F ./eip_environment_types.F ./qs_spin_orbit.F ./qs_fb_env_types.F ./mao_methods.F ./distribution_2d_types.F ./aobasis/orbital_symbols.F ./aobasis/ai_overlap.F ./aobasis/ai_eri_debug.F ./aobasis/ai_verfc.F ./aobasis/aux_basis_set.F ./aobasis/ai_moments.F ./aobasis/ai_coulomb_test.F ./aobasis/orbital_transformation_matrices.F ./aobasis/ai_fermi_contact.F ./aobasis/ai_overlap_debug.F ./aobasis/ao_util.F ./aobasis/ai_coulomb.F ./aobasis/ai_overlap3.F ./aobasis/basis_set_types.F ./aobasis/ai_angmom.F ./aobasis/ai_elec_field.F ./aobasis/basis_set_container_types.F ./aobasis/orbital_pointers.F ./aobasis/sto_ng.F ./aobasis/ai_operators_r12.F ./aobasis/ai_oneelectron.F ./aobasis/ai_operator_ra2m.F ./aobasis/ai_overlap_ppl.F ./aobasis/ai_derivatives.F ./aobasis/ai_overlap_aabb.F ./aobasis/ai_spin_orbit.F ./aobasis/ai_os_rr.F ./aobasis/ai_contraction_sphi.F ./aobasis/ai_overlap3_debug.F ./aobasis/ai_kinetic.F ./aobasis/soft_basis_set.F ./aobasis/ai_contraction.F ./aobasis/ai_onecenter.F ./qs_force.F ./semi_empirical_int_arrays.F ./mixed_cdft_methods.F ./bse.F ./xas_tdp_kernel.F ./qs_energy_utils.F ./qs_linres_module.F ./input_cp2k_xc.F ./constraint_clv.F ./fist_intra_force.F ./spglib_f08.F ./qmmm_tb_methods.F ./qs_energy_types.F ./qs_loc_methods.F ./qs_loc_molecules.F ./topology_xtl.F ./qs_p_env_methods.F ./hfx_types.F ./xas_env_types.F ./almo_scf_diis_types.F ./mp2_ri_libint.F ./input_cp2k_pwdft.F ./base/machine_cpuid.c ./sockets.c ./grid/grid_unittest.c ./grid/common/grid_buffer.c ./grid/common/grid_sphere_cache.c ./grid/common/grid_basis_set.c ./grid/common/grid_library.c ./grid/grid_replay.c ./grid/grid_task_list.c ./grid/hybrid/grid_integrate_hybrid.c ./grid/hybrid/grid_collocate_hybrid.c ./grid/ref/grid_ref_integrate.c ./grid/ref/grid_ref_prepare_pab.c ./grid/ref/grid_ref_task_list.c ./grid/ref/grid_ref_collocate.c ./grid/cpu/coefficients.c ./grid/cpu/grid_collocate_dgemm.c ./grid/cpu/grid_context_cpu.c ./grid/cpu/non_orthorombic_corrections.c ./grid/cpu/collocation_integration.c ./grid/cpu/grid_prepare_pab_dgemm.c ./grid/cpu/tensor_local.c ./grid/cpu/grid_integrate_dgemm.c ./grid/cpu/utils.c ./grid/grid_miniapp.c ./start/libcp2k_unittest.c ./pw/fpga/fft_fpga.c ./pw/fpga/opencl_utils.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/utils/dbcsr_array_sort.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_btree.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_files.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_min_heap.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_methods.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_util.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/block/dbcsr_index_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_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/mm/dbcsr_acc_operations.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_multrec.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_dist_operations.F 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/build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_io.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_mpiwrap.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mp_methods.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/acc_bench_trans.c /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/acc_bench_smm.c /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 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine_posix.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/dbcsr.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/libsmm_acc.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/libsmm_acc/kernels/smm_acc_dnt_medium.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_small.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_common.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/libsmm_acc_init.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/cuda/acc_cuda.h /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/acc_libsmm.h /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/acc/acc.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/utils/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/mm/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/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/libsmm_acc/libcusmm/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/tas/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/data/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/ops/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/PACKAGE /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/mpi/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 ./utils/dbcsr_array_sort.F ./utils/dbcsr_toollib.F ./utils/dbcsr_btree.F ./utils/dbcsr_string_utilities.F ./utils/dbcsr_files.F ./utils/dbcsr_blas_operations.F ./utils/dbcsr_min_heap.F ./dist/dbcsr_dist_methods.F ./dist/dbcsr_dist_operations.F ./dist/dbcsr_dist_util.F ./block/dbcsr_index_operations.F ./block/dbcsr_block_access.F ./block/dbcsr_block_operations.F ./block/dbcsr_iterator_operations.F ./mm/dbcsr_acc_operations.F ./mm/dbcsr_mm_3d.F ./mm/dbcsr_mm_multrec.F ./mm/dbcsr_mm_dist_operations.F ./mm/dbcsr_mm_common.F ./mm/dbcsr_multiply_api.F ./mm/dbcsr_mm_hostdrv.F ./mm/dbcsr_mm_types.F ./mm/dbcsr_mm_cannon.F ./mm/dbcsr_mm_sched.F ./mm/dbcsr_mm.F ./mm/dbcsr_mm_csr.F ./mm/dbcsr_mm_accdrv.F ./base/dbcsr_machine.F ./base/dbcsr_kinds.F ./base/dbcsr_machine_internal.F ./base/dbcsr_base_hooks.F ./acc/dbcsr_acc_timings.F ./acc/dbcsr_acc_device.F ./acc/dbcsr_acc_init.F ./acc/cuda/dbcsr_cuda_profiling.F ./acc/dbcsr_acc_event.F ./acc/dbcsr_acc_hostmem.F ./acc/dbcsr_acc_stream.F ./acc/dbcsr_acc_devmem.F ./acc/hip/dbcsr_hipblas.F ./tas/dbcsr_tas_util.F ./tas/dbcsr_tas_types.F ./tas/dbcsr_tas_test.F ./tas/dbcsr_tas_reshape_ops.F ./tas/dbcsr_tas_base.F ./tas/dbcsr_tas_io.F ./tas/dbcsr_tas_split.F ./tas/dbcsr_tas_global.F ./tas/dbcsr_tas_mm.F ./data/dbcsr_data_operations.F ./data/dbcsr_mem_methods.F ./data/dbcsr_ptr_util.F ./data/dbcsr_data_methods_low.F ./data/dbcsr_data_types.F ./data/dbcsr_data_methods.F ./ops/dbcsr_test_methods.F ./ops/dbcsr_csr_conversions.F ./ops/dbcsr_tests.F ./ops/dbcsr_io.F ./ops/dbcsr_transformations.F ./ops/dbcsr_operations.F ./dbcsr_api.F ./core/dbcsr_timings_types.F ./core/dbcsr_list.F ./core/dbcsr_config.F ./core/dbcsr_print_messages.F ./core/dbcsr_lib.F ./core/dbcsr_types.F ./core/dbcsr_methods.F ./core/dbcsr_list_callstackentry.F ./core/dbcsr_array_types.F ./core/dbcsr_error_handling.F ./core/dbcsr_list_routinereport.F ./core/dbcsr_list_routinestat.F ./core/dbcsr_iter_types.F ./core/dbcsr_timings.F ./core/dbcsr_timings_report.F ./core/dbcsr_log_handling.F ./core/dbcsr_timings_base_type.F ./core/dbcsr_dict.F ./core/dbcsr_list_timerenv.F ./tensors/dbcsr_tensor_api.F ./tensors/dbcsr_tensor_split.F ./tensors/dbcsr_tensor_reshape.F ./tensors/dbcsr_tensor_block.F ./tensors/dbcsr_allocate_wrap.F ./tensors/dbcsr_tensor_types.F ./tensors/dbcsr_tensor_index.F ./tensors/dbcsr_tensor_test.F ./tensors/dbcsr_tensor.F ./tensors/dbcsr_array_list_methods.F ./tensors/dbcsr_tensor_io.F ./mpi/dbcsr_mp_operations.F ./mpi/dbcsr_mpiwrap.F ./mpi/dbcsr_mp_methods.F ./acc/acc_bench_trans.c ./acc/acc_bench_smm.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_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_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_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/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_base_hooks.mod dbcsr_acc_stream.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_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/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_base_hooks.mod dbcsr_acc_stream.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_kinds.mod dbcsr_acc_event.mod dbcsr_acc_devmem.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/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_kinds.mod dbcsr_acc_event.mod dbcsr_acc_devmem.mod dbcsr_acc_stream.mod 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_array_types.mod dbcsr_data_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_array_types.mod dbcsr_data_types.mod dbcsr_kinds.mod dbcsr_btree.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_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_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/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_machine.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_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/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_base_hooks.mod dbcsr_acc_stream.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_kinds.mod dbcsr_mpiwrap.mod dbcsr_base_hooks.mod dbcsr_acc_hostmem.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_kinds.mod dbcsr_mpiwrap.mod dbcsr_base_hooks.mod dbcsr_acc_hostmem.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_kinds.mod dbcsr_acc_event.mod dbcsr_acc_devmem.mod dbcsr_base_hooks.mod dbcsr_ptr_util.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_kinds.mod dbcsr_acc_event.mod dbcsr_acc_devmem.mod dbcsr_base_hooks.mod dbcsr_ptr_util.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_kinds.mod dbcsr_acc_devmem.mod dbcsr_data_methods_low.mod dbcsr_ptr_util.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/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_kinds.mod dbcsr_acc_devmem.mod dbcsr_data_methods_low.mod dbcsr_ptr_util.mod dbcsr_base_hooks.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_kinds.mod dbcsr_base_hooks.mod dbcsr_data_methods_low.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_kinds.mod dbcsr_base_hooks.mod dbcsr_data_methods_low.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_kinds.mod dbcsr_acc_event.mod dbcsr_mem_methods.mod dbcsr_acc_devmem.mod dbcsr_base_hooks.mod dbcsr_data_methods_low.mod dbcsr_ptr_util.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_kinds.mod dbcsr_acc_event.mod dbcsr_mem_methods.mod dbcsr_acc_devmem.mod dbcsr_base_hooks.mod dbcsr_data_methods_low.mod dbcsr_ptr_util.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_kinds.mod dbcsr_mpiwrap.mod dbcsr_acc_device.mod dbcsr_ptr_util.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_kinds.mod dbcsr_mpiwrap.mod dbcsr_acc_device.mod dbcsr_ptr_util.mod dbcsr_base_hooks.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_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_ptr_util.mod dbcsr_base_hooks.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_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_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_ptr_util.mod dbcsr_base_hooks.mod dbcsr_btree.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_methods.mod dbcsr_base_hooks.mod dbcsr_mpiwrap.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_methods.mod dbcsr_base_hooks.mod dbcsr_mpiwrap.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_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_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_config.mod dbcsr_mp_methods.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_min_heap.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_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_config.mod dbcsr_mp_methods.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_min_heap.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_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_mp_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/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_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_mp_methods.mod dbcsr_methods.mod dbcsr_base_hooks.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_kinds.mod dbcsr_block_operations.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_dist_util.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_kinds.mod dbcsr_block_operations.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_dist_util.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_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_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_mp_methods.mod dbcsr_dist_methods.mod dbcsr_base_hooks.mod dbcsr_min_heap.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_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_mp_methods.mod dbcsr_dist_methods.mod dbcsr_base_hooks.mod dbcsr_min_heap.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_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_config.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_ptr_util.mod dbcsr_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/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_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_config.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_ptr_util.mod dbcsr_dist_operations.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_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_ptr_util.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/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_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_ptr_util.mod dbcsr_base_hooks.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_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_block_operations.mod dbcsr_data_methods.mod dbcsr_config.mod dbcsr_dist_methods.mod dbcsr_mem_methods.mod dbcsr_data_operations.mod dbcsr_methods.mod dbcsr_string_utilities.mod dbcsr_base_hooks.mod dbcsr_ptr_util.mod dbcsr_index_operations.mod dbcsr_iterator_operations.mod dbcsr_dist_util.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/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_kinds.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_config.mod dbcsr_mp_methods.mod dbcsr_ptr_util.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_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_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_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_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_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_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_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_timings_types.o' due to: /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings_types.F dbcsr_dict.mod dbcsr_list_routinestat.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_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 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_list_routinereport.mod dbcsr_base_hooks.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: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: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_array_types.mod dbcsr_types.mod dbcsr_toollib.mod dbcsr_mp_methods.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_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_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_array_types.mod dbcsr_types.mod dbcsr_toollib.mod dbcsr_mp_methods.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_dist_operations.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_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_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_block_operations.mod dbcsr_data_methods.mod dbcsr_config.mod dbcsr_dist_methods.mod dbcsr_mp_methods.mod dbcsr_methods.mod dbcsr_work_operations.mod dbcsr_base_hooks.mod dbcsr_ptr_util.mod dbcsr_index_operations.mod dbcsr_dist_operations.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/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_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_block_operations.mod dbcsr_data_methods.mod dbcsr_config.mod dbcsr_dist_methods.mod dbcsr_mp_methods.mod dbcsr_methods.mod dbcsr_work_operations.mod dbcsr_base_hooks.mod dbcsr_ptr_util.mod dbcsr_index_operations.mod dbcsr_dist_operations.mod dbcsr_btree.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_toollib.mod dbcsr_dist_operations.mod dbcsr_kinds.mod dbcsr_config.mod dbcsr_data_methods.mod dbcsr_mp_methods.mod dbcsr_methods.mod dbcsr_ptr_util.mod dbcsr_block_access.mod dbcsr_base_hooks.mod dbcsr_blas_operations.mod dbcsr_block_operations.mod dbcsr_data_operations.mod dbcsr_work_operations.mod dbcsr_index_operations.mod dbcsr_iterator_operations.mod dbcsr_mpiwrap.mod dbcsr_dist_methods.mod dbcsr_dist_util.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_toollib.mod dbcsr_dist_operations.mod dbcsr_kinds.mod dbcsr_config.mod dbcsr_data_methods.mod dbcsr_mp_methods.mod dbcsr_methods.mod dbcsr_ptr_util.mod dbcsr_block_access.mod dbcsr_base_hooks.mod dbcsr_blas_operations.mod dbcsr_block_operations.mod dbcsr_data_operations.mod dbcsr_work_operations.mod dbcsr_index_operations.mod dbcsr_iterator_operations.mod dbcsr_mpiwrap.mod dbcsr_dist_methods.mod dbcsr_dist_util.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_dist_operations.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_mp_methods.mod dbcsr_methods.mod dbcsr_mp_operations.mod dbcsr_ptr_util.mod dbcsr_operations.mod dbcsr_block_access.mod dbcsr_base_hooks.mod dbcsr_block_operations.mod dbcsr_data_operations.mod dbcsr_work_operations.mod dbcsr_index_operations.mod dbcsr_iterator_operations.mod dbcsr_mpiwrap.mod dbcsr_dist_methods.mod dbcsr_dist_util.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_dist_operations.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_mp_methods.mod dbcsr_methods.mod dbcsr_mp_operations.mod dbcsr_ptr_util.mod dbcsr_operations.mod dbcsr_block_access.mod dbcsr_base_hooks.mod dbcsr_block_operations.mod dbcsr_data_operations.mod dbcsr_work_operations.mod dbcsr_index_operations.mod dbcsr_iterator_operations.mod dbcsr_mpiwrap.mod dbcsr_dist_methods.mod dbcsr_dist_util.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_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_machine.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_mp_methods.mod dbcsr_methods.mod dbcsr_mp_operations.mod dbcsr_work_operations.mod dbcsr_base_hooks.mod dbcsr_transformations.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_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_machine.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_mp_methods.mod dbcsr_methods.mod dbcsr_mp_operations.mod dbcsr_work_operations.mod dbcsr_base_hooks.mod dbcsr_transformations.mod true /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_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_config.mod dbcsr_acc_devmem.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/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_config.mod dbcsr_acc_devmem.mod dbcsr_acc_stream.mod dbcsr_base_hooks.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_kinds.mod dbcsr_toollib.mod dbcsr_acc_event.mod dbcsr_block_operations.mod dbcsr_config.mod dbcsr_data_methods.mod dbcsr_mem_methods.mod dbcsr_acc_devmem.mod dbcsr_acc_operations.mod dbcsr_acc_stream.mod dbcsr_acc_hostmem.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_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_kinds.mod dbcsr_toollib.mod dbcsr_acc_event.mod dbcsr_block_operations.mod dbcsr_config.mod dbcsr_data_methods.mod dbcsr_mem_methods.mod dbcsr_acc_devmem.mod dbcsr_acc_operations.mod dbcsr_acc_stream.mod dbcsr_acc_hostmem.mod dbcsr_base_hooks.mod 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_config.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_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_config.mod dbcsr_base_hooks.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_kinds.mod dbcsr_toollib.mod dbcsr_block_operations.mod dbcsr_data_methods.mod dbcsr_config.mod dbcsr_mpiwrap.mod dbcsr_mm_accdrv.mod dbcsr_mm_hostdrv.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_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_kinds.mod dbcsr_toollib.mod dbcsr_block_operations.mod dbcsr_data_methods.mod dbcsr_config.mod dbcsr_mpiwrap.mod dbcsr_mm_accdrv.mod dbcsr_mm_hostdrv.mod dbcsr_base_hooks.mod 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/base/dbcsr_base_uses.f90 /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 dbcsr_array_types.mod dbcsr_mm_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_block_operations.mod dbcsr_data_methods.mod dbcsr_config.mod dbcsr_mm_sched.mod dbcsr_ptr_util.mod dbcsr_base_hooks.mod dbcsr_dist_util.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/base/dbcsr_base_uses.f90 /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 dbcsr_array_types.mod dbcsr_mm_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_block_operations.mod dbcsr_data_methods.mod dbcsr_config.mod dbcsr_mm_sched.mod dbcsr_ptr_util.mod dbcsr_base_hooks.mod dbcsr_dist_util.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_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_config.mod dbcsr_dist_methods.mod dbcsr_mm_csr.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_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_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_config.mod dbcsr_dist_methods.mod dbcsr_mm_csr.mod dbcsr_base_hooks.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_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_acc_event.mod dbcsr_data_methods.mod dbcsr_methods.mod dbcsr_work_operations.mod dbcsr_acc_operations.mod dbcsr_ptr_util.mod dbcsr_acc_stream.mod dbcsr_mm_multrec.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_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_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_acc_event.mod dbcsr_data_methods.mod dbcsr_methods.mod dbcsr_work_operations.mod dbcsr_acc_operations.mod dbcsr_ptr_util.mod dbcsr_acc_stream.mod dbcsr_mm_multrec.mod dbcsr_base_hooks.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_types.mod dbcsr_data_types.mod dbcsr_mm_dist_operations.mod dbcsr_kinds.mod dbcsr_acc_event.mod dbcsr_data_methods.mod dbcsr_config.mod dbcsr_mem_methods.mod dbcsr_mp_methods.mod dbcsr_methods.mod dbcsr_mp_operations.mod dbcsr_ptr_util.mod dbcsr_operations.mod dbcsr_io.mod dbcsr_transformations.mod dbcsr_base_hooks.mod dbcsr_mm_common.mod dbcsr_block_operations.mod dbcsr_work_operations.mod dbcsr_index_operations.mod dbcsr_iterator_operations.mod dbcsr_machine.mod dbcsr_mpiwrap.mod dbcsr_dist_methods.mod dbcsr_mm_multrec.mod dbcsr_dist_util.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_types.mod dbcsr_data_types.mod dbcsr_mm_dist_operations.mod dbcsr_kinds.mod dbcsr_acc_event.mod dbcsr_data_methods.mod dbcsr_config.mod dbcsr_mem_methods.mod dbcsr_mp_methods.mod dbcsr_methods.mod dbcsr_mp_operations.mod dbcsr_ptr_util.mod dbcsr_operations.mod dbcsr_io.mod dbcsr_transformations.mod dbcsr_base_hooks.mod dbcsr_mm_common.mod dbcsr_block_operations.mod dbcsr_work_operations.mod dbcsr_index_operations.mod dbcsr_iterator_operations.mod dbcsr_machine.mod dbcsr_mpiwrap.mod dbcsr_dist_methods.mod dbcsr_mm_multrec.mod dbcsr_dist_util.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_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_types.mod dbcsr_data_types.mod dbcsr_mm_dist_operations.mod dbcsr_kinds.mod dbcsr_acc_event.mod dbcsr_data_methods.mod dbcsr_config.mod dbcsr_mem_methods.mod dbcsr_mp_methods.mod dbcsr_methods.mod dbcsr_mp_operations.mod dbcsr_ptr_util.mod dbcsr_base_hooks.mod dbcsr_mm_common.mod dbcsr_block_operations.mod dbcsr_work_operations.mod dbcsr_index_operations.mod dbcsr_iterator_operations.mod dbcsr_machine.mod dbcsr_mpiwrap.mod dbcsr_dist_methods.mod dbcsr_mm_multrec.mod dbcsr_dist_util.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_types.mod dbcsr_data_types.mod dbcsr_mm_dist_operations.mod dbcsr_kinds.mod dbcsr_acc_event.mod dbcsr_data_methods.mod dbcsr_config.mod dbcsr_mem_methods.mod dbcsr_mp_methods.mod dbcsr_methods.mod dbcsr_mp_operations.mod dbcsr_ptr_util.mod dbcsr_base_hooks.mod dbcsr_mm_common.mod dbcsr_block_operations.mod dbcsr_work_operations.mod dbcsr_index_operations.mod dbcsr_iterator_operations.mod dbcsr_machine.mod dbcsr_mpiwrap.mod dbcsr_dist_methods.mod dbcsr_mm_multrec.mod dbcsr_dist_util.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_cannon.mod dbcsr_mm_dist_operations.mod dbcsr_kinds.mod dbcsr_config.mod dbcsr_data_methods.mod dbcsr_mem_methods.mod dbcsr_mp_methods.mod dbcsr_methods.mod dbcsr_mm_sched.mod dbcsr_acc_stream.mod dbcsr_io.mod dbcsr_operations.mod dbcsr_transformations.mod dbcsr_base_hooks.mod dbcsr_mm_common.mod dbcsr_string_utilities.mod dbcsr_work_operations.mod dbcsr_acc_device.mod dbcsr_index_operations.mod dbcsr_acc_init.mod dbcsr_machine.mod dbcsr_mpiwrap.mod dbcsr_dist_methods.mod dbcsr_mm_3d.mod dbcsr_mm_multrec.mod dbcsr_dist_util.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_cannon.mod dbcsr_mm_dist_operations.mod dbcsr_kinds.mod dbcsr_config.mod dbcsr_data_methods.mod dbcsr_mem_methods.mod dbcsr_mp_methods.mod dbcsr_methods.mod dbcsr_mm_sched.mod dbcsr_acc_stream.mod dbcsr_io.mod dbcsr_operations.mod dbcsr_transformations.mod dbcsr_base_hooks.mod dbcsr_mm_common.mod dbcsr_string_utilities.mod dbcsr_work_operations.mod dbcsr_acc_device.mod dbcsr_index_operations.mod dbcsr_acc_init.mod dbcsr_machine.mod dbcsr_mpiwrap.mod dbcsr_dist_methods.mod dbcsr_mm_3d.mod dbcsr_mm_multrec.mod dbcsr_dist_util.mod true /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:284: update target 'dbcsr_iter_types.mod' due to: dbcsr_iter_types.o /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 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:284: update target 'dbcsr_cuda_profiling.mod' due to: dbcsr_cuda_profiling.o true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_list.mod' due to: dbcsr_list.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_kinds.mod dbcsr_machine.mod dbcsr_dict.mod dbcsr_acc_devmem.mod dbcsr_cuda_profiling.mod dbcsr_list.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_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_kinds.mod dbcsr_machine.mod dbcsr_dict.mod dbcsr_acc_devmem.mod dbcsr_cuda_profiling.mod dbcsr_list.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_iter_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_machine.mod dbcsr_methods.mod dbcsr_string_utilities.mod dbcsr_files.mod dbcsr_timings.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_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_iter_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_machine.mod dbcsr_methods.mod dbcsr_string_utilities.mod dbcsr_files.mod dbcsr_timings.mod dbcsr_base_hooks.mod true /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_print_messages.mod' due to: dbcsr_print_messages.o 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_kinds.mod dbcsr_machine.mod dbcsr_mpiwrap.mod dbcsr_log_handling.mod dbcsr_print_messages.mod dbcsr_timings.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_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_kinds.mod dbcsr_machine.mod dbcsr_mpiwrap.mod dbcsr_log_handling.mod dbcsr_print_messages.mod dbcsr_timings.mod dbcsr_base_hooks.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_types.mod dbcsr_timings_types.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_mpiwrap.mod dbcsr_dict.mod dbcsr_files.mod dbcsr_timings.mod dbcsr_list.mod dbcsr_list_routinereport.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_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_types.mod dbcsr_timings_types.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_mpiwrap.mod dbcsr_dict.mod dbcsr_files.mod dbcsr_timings.mod dbcsr_list.mod dbcsr_list_routinereport.mod dbcsr_base_hooks.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_kinds.mod dbcsr_machine.mod dbcsr_mpiwrap.mod dbcsr_config.mod dbcsr_mm.mod dbcsr_log_handling.mod dbcsr_mp_methods.mod dbcsr_error_handling.mod dbcsr_timings_report.mod dbcsr_acc_device.mod dbcsr_timings.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_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_kinds.mod dbcsr_data_methods.mod dbcsr_mm.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_iterator_operations.mod dbcsr_blas_operations.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_mp_methods.mod dbcsr_mpiwrap.mod dbcsr_methods.mod dbcsr_work_operations.mod dbcsr_dist_util.mod dbcsr_base_hooks.mod dbcsr_ptr_util.mod dbcsr_dist_operations.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: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_kinds.mod dbcsr_transformations.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_mp_methods.mod dbcsr_methods.mod dbcsr_work_operations.mod dbcsr_base_hooks.mod dbcsr_operations.mod dbcsr_iterator_operations.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:284: update target 'dbcsr_test_methods.mod' due to: dbcsr_test_methods.o 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_kinds.mod dbcsr_machine.mod dbcsr_transformations.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_mp_methods.mod dbcsr_methods.mod dbcsr_test_methods.mod dbcsr_work_operations.mod dbcsr_base_hooks.mod dbcsr_operations.mod dbcsr_io.mod dbcsr_dist_operations.mod dbcsr_multiply_api.mod dbcsr_dist_util.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_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_index_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/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: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_tas_global.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_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:284: update target 'dbcsr_tas_util.mod' due to: dbcsr_tas_util.o 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_toollib.mod dbcsr_mpiwrap.mod dbcsr_tas_util.mod dbcsr_tas_global.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_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 /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_toollib.mod dbcsr_mpiwrap.mod dbcsr_tas_util.mod dbcsr_tas_global.mod dbcsr_base_hooks.mod 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_tas_types.mod dbcsr_types.mod dbcsr_data_types.mod dbcsr_iterator_operations.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_work_operations.mod dbcsr_tas_split.mod dbcsr_tas_util.mod dbcsr_tas_global.mod dbcsr_base_hooks.mod dbcsr_data_methods_low.mod dbcsr_operations.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 /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_tas_types.mod dbcsr_types.mod dbcsr_data_types.mod dbcsr_iterator_operations.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_work_operations.mod dbcsr_tas_split.mod dbcsr_tas_util.mod dbcsr_tas_global.mod dbcsr_base_hooks.mod dbcsr_data_methods_low.mod dbcsr_operations.mod dbcsr_block_access.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_kinds.mod dbcsr_mpiwrap.mod dbcsr_dist_methods.mod dbcsr_tas_split.mod dbcsr_tas_global.mod dbcsr_tas_base.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_kinds.mod dbcsr_mpiwrap.mod dbcsr_dist_methods.mod dbcsr_tas_split.mod dbcsr_tas_global.mod dbcsr_tas_base.mod 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_types.mod dbcsr_data_types.mod dbcsr_tas_util.mod dbcsr_dist_operations.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_methods.mod dbcsr_tas_split.mod dbcsr_operations.mod dbcsr_base_hooks.mod dbcsr_work_operations.mod dbcsr_iterator_operations.mod dbcsr_mpiwrap.mod dbcsr_dist_methods.mod dbcsr_tas_global.mod dbcsr_data_methods_low.mod dbcsr_tas_base.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_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_types.mod dbcsr_data_types.mod dbcsr_tas_util.mod dbcsr_dist_operations.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_methods.mod dbcsr_tas_split.mod dbcsr_operations.mod dbcsr_base_hooks.mod dbcsr_work_operations.mod dbcsr_iterator_operations.mod dbcsr_mpiwrap.mod dbcsr_dist_methods.mod dbcsr_tas_global.mod dbcsr_data_methods_low.mod dbcsr_tas_base.mod dbcsr_block_access.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_types.mod dbcsr_data_types.mod dbcsr_tas_util.mod dbcsr_multiply_api.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_config.mod dbcsr_methods.mod dbcsr_tas_split.mod dbcsr_operations.mod dbcsr_transformations.mod dbcsr_base_hooks.mod dbcsr_work_operations.mod dbcsr_tas_io.mod dbcsr_tas_reshape_ops.mod dbcsr_mpiwrap.mod dbcsr_dist_methods.mod dbcsr_tas_global.mod dbcsr_tas_base.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_types.mod dbcsr_data_types.mod dbcsr_tas_util.mod dbcsr_multiply_api.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_config.mod dbcsr_methods.mod dbcsr_tas_split.mod dbcsr_operations.mod dbcsr_transformations.mod dbcsr_base_hooks.mod dbcsr_work_operations.mod dbcsr_tas_io.mod dbcsr_tas_reshape_ops.mod dbcsr_mpiwrap.mod dbcsr_dist_methods.mod dbcsr_tas_global.mod dbcsr_tas_base.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_util.mod dbcsr_multiply_api.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_methods.mod dbcsr_tas_split.mod dbcsr_operations.mod dbcsr_base_hooks.mod dbcsr_transformations.mod dbcsr_blas_operations.mod dbcsr_work_operations.mod dbcsr_mpiwrap.mod dbcsr_dist_methods.mod dbcsr_tas_global.mod dbcsr_tas_mm.mod dbcsr_tas_base.mod dbcsr_dist_util.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_lib.mod' due to: dbcsr_lib.o true /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_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/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_lib.mod dbcsr_dist_operations.mod dbcsr_multiply_api.mod dbcsr_kinds.mod dbcsr_config.mod dbcsr_data_methods.mod dbcsr_mp_methods.mod dbcsr_methods.mod dbcsr_operations.mod dbcsr_transformations.mod dbcsr_io.mod dbcsr_base_hooks.mod dbcsr_string_utilities.mod dbcsr_work_operations.mod dbcsr_tests.mod dbcsr_iterator_operations.mod dbcsr_mpiwrap.mod dbcsr_csr_conversions.mod dbcsr_dist_methods.mod dbcsr_test_methods.mod dbcsr_dist_util.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/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/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp 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/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp 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/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_allocate_wrap.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/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_allocate_wrap.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/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tensor_index.mod dbcsr_base_hooks.mod dbcsr_allocate_wrap.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_array_list_methods.mod' due to: dbcsr_array_list_methods.o /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_array_list_methods.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tensor_index.mod dbcsr_base_hooks.mod dbcsr_allocate_wrap.mod true /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: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/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tas_types.mod dbcsr_data_types.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_mpiwrap.mod dbcsr_tensor_index.mod dbcsr_array_list_methods.mod dbcsr_tas_split.mod dbcsr_allocate_wrap.mod dbcsr_tas_global.mod dbcsr_base_hooks.mod dbcsr_tas_mm.mod dbcsr_operations.mod dbcsr_tas_base.mod dbcsr_api.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/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tas_types.mod dbcsr_data_types.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_mpiwrap.mod dbcsr_tensor_index.mod dbcsr_array_list_methods.mod dbcsr_tas_split.mod dbcsr_allocate_wrap.mod dbcsr_tas_global.mod dbcsr_base_hooks.mod dbcsr_tas_mm.mod dbcsr_operations.mod dbcsr_tas_base.mod dbcsr_api.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/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tas_types.mod dbcsr_tensor_types.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_allocate_wrap.mod dbcsr_array_list_methods.mod dbcsr_base_hooks.mod dbcsr_tensor_index.mod dbcsr_dist_operations.mod dbcsr_tas_base.mod dbcsr_api.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 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_block.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tas_types.mod dbcsr_tensor_types.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_allocate_wrap.mod dbcsr_array_list_methods.mod dbcsr_base_hooks.mod dbcsr_tensor_index.mod dbcsr_dist_operations.mod dbcsr_tas_base.mod dbcsr_api.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/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tensor_types.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_tas_io.mod dbcsr_tensor_block.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_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/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tensor_types.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_tas_io.mod dbcsr_tensor_block.mod dbcsr_base_hooks.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_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/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tensor_types.mod dbcsr_kinds.mod dbcsr_allocate_wrap.mod dbcsr_array_list_methods.mod dbcsr_tensor_block.mod dbcsr_tensor_index.mod dbcsr_base_hooks.mod dbcsr_api.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/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tensor_types.mod dbcsr_kinds.mod dbcsr_allocate_wrap.mod dbcsr_array_list_methods.mod dbcsr_tensor_block.mod dbcsr_tensor_index.mod dbcsr_base_hooks.mod dbcsr_api.mod 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/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tensor_types.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_allocate_wrap.mod dbcsr_tensor_block.mod dbcsr_base_hooks.mod dbcsr_tas_base.mod dbcsr_api.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/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tensor_types.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_allocate_wrap.mod dbcsr_tensor_block.mod dbcsr_base_hooks.mod dbcsr_tas_base.mod dbcsr_api.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/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tas_types.mod dbcsr_tensor_types.mod dbcsr_data_types.mod dbcsr_toollib.mod dbcsr_allocate_wrap.mod dbcsr_dist_operations.mod dbcsr_kinds.mod dbcsr_tas_split.mod dbcsr_tensor_block.mod dbcsr_base_hooks.mod dbcsr_tensor_split.mod dbcsr_array_list_methods.mod dbcsr_tensor_index.mod dbcsr_api.mod dbcsr_mpiwrap.mod dbcsr_tensor_reshape.mod dbcsr_tensor_io.mod dbcsr_tas_mm.mod dbcsr_tas_base.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/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tas_types.mod dbcsr_tensor_types.mod dbcsr_data_types.mod dbcsr_toollib.mod dbcsr_allocate_wrap.mod dbcsr_dist_operations.mod dbcsr_kinds.mod dbcsr_tas_split.mod dbcsr_tensor_block.mod dbcsr_base_hooks.mod dbcsr_tensor_split.mod dbcsr_array_list_methods.mod dbcsr_tensor_index.mod dbcsr_api.mod dbcsr_mpiwrap.mod dbcsr_tensor_reshape.mod dbcsr_tensor_io.mod dbcsr_tas_mm.mod dbcsr_tas_base.mod 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/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tensor_types.mod dbcsr_data_types.mod dbcsr_kinds.mod dbcsr_blas_operations.mod dbcsr_tas_base.mod dbcsr_mpiwrap.mod dbcsr_tas_test.mod dbcsr_tensor_io.mod dbcsr_allocate_wrap.mod dbcsr_base_hooks.mod dbcsr_tensor_block.mod dbcsr_tensor_index.mod dbcsr_tensor.mod dbcsr_api.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 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_test.F /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/cp2k-Q381vr/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tensor_types.mod dbcsr_data_types.mod dbcsr_kinds.mod dbcsr_blas_operations.mod dbcsr_tas_base.mod dbcsr_mpiwrap.mod dbcsr_tas_test.mod dbcsr_tensor_io.mod dbcsr_allocate_wrap.mod dbcsr_base_hooks.mod dbcsr_tensor_block.mod dbcsr_tensor_index.mod dbcsr_tensor.mod dbcsr_api.mod 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_io.mod dbcsr_tensor_test.mod dbcsr_tensor_block.mod dbcsr_tensor_index.mod dbcsr_tensor.mod dbcsr_tensor_split.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_machine.o dbcsr_kinds.o dbcsr_machine_internal.o dbcsr_base_hooks.o dbcsr_dist_methods.o dbcsr_dist_operations.o dbcsr_dist_util.o dbcsr_mp_operations.o dbcsr_mpiwrap.o dbcsr_mp_methods.o dbcsr_data_operations.o dbcsr_mem_methods.o dbcsr_ptr_util.o dbcsr_data_methods_low.o dbcsr_data_types.o dbcsr_data_methods.o dbcsr_acc_timings.o dbcsr_acc_device.o dbcsr_acc_init.o dbcsr_acc_event.o dbcsr_acc_hostmem.o dbcsr_acc_stream.o dbcsr_acc_devmem.o dbcsr_cuda_profiling.o dbcsr_hipblas.o dbcsr_timings_types.o dbcsr_list.o dbcsr_config.o dbcsr_print_messages.o dbcsr_lib.o dbcsr_types.o dbcsr_methods.o dbcsr_list_callstackentry.o dbcsr_array_types.o dbcsr_error_handling.o dbcsr_list_routinereport.o dbcsr_list_routinestat.o dbcsr_iter_types.o dbcsr_timings.o dbcsr_timings_report.o dbcsr_log_handling.o dbcsr_timings_base_type.o dbcsr_dict.o dbcsr_list_timerenv.o dbcsr_acc_operations.o dbcsr_mm_3d.o dbcsr_mm_multrec.o dbcsr_mm_dist_operations.o dbcsr_mm_common.o dbcsr_multiply_api.o dbcsr_mm_hostdrv.o dbcsr_mm_types.o dbcsr_mm_cannon.o dbcsr_mm_sched.o dbcsr_mm.o dbcsr_mm_csr.o dbcsr_mm_accdrv.o dbcsr_index_operations.o dbcsr_block_access.o dbcsr_block_operations.o dbcsr_iterator_operations.o dbcsr_array_sort.o dbcsr_toollib.o dbcsr_btree.o dbcsr_string_utilities.o dbcsr_files.o dbcsr_blas_operations.o dbcsr_min_heap.o dbcsr_test_methods.o dbcsr_csr_conversions.o dbcsr_tests.o dbcsr_io.o dbcsr_transformations.o dbcsr_operations.o dbcsr_tas_util.o dbcsr_tas_types.o dbcsr_tas_test.o dbcsr_tas_reshape_ops.o dbcsr_tas_base.o dbcsr_tas_io.o dbcsr_tas_split.o dbcsr_tas_global.o dbcsr_tas_mm.o dbcsr_api.o dbcsr_tensor_api.o dbcsr_tensor_split.o dbcsr_tensor_reshape.o dbcsr_tensor_block.o dbcsr_allocate_wrap.o dbcsr_tensor_types.o dbcsr_tensor_index.o dbcsr_tensor_test.o dbcsr_tensor.o dbcsr_array_list_methods.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_machine.o dbcsr_kinds.o dbcsr_machine_internal.o dbcsr_base_hooks.o dbcsr_dist_methods.o dbcsr_dist_operations.o dbcsr_dist_util.o dbcsr_mp_operations.o dbcsr_mpiwrap.o dbcsr_mp_methods.o dbcsr_data_operations.o dbcsr_mem_methods.o dbcsr_ptr_util.o dbcsr_data_methods_low.o dbcsr_data_types.o dbcsr_data_methods.o dbcsr_acc_timings.o dbcsr_acc_device.o dbcsr_acc_init.o dbcsr_acc_event.o dbcsr_acc_hostmem.o dbcsr_acc_stream.o dbcsr_acc_devmem.o dbcsr_cuda_profiling.o dbcsr_hipblas.o dbcsr_timings_types.o dbcsr_list.o dbcsr_config.o dbcsr_print_messages.o dbcsr_lib.o dbcsr_types.o dbcsr_methods.o dbcsr_list_callstackentry.o dbcsr_array_types.o dbcsr_error_handling.o dbcsr_list_routinereport.o dbcsr_list_routinestat.o dbcsr_iter_types.o dbcsr_timings.o dbcsr_timings_report.o dbcsr_log_handling.o dbcsr_timings_base_type.o dbcsr_dict.o dbcsr_list_timerenv.o dbcsr_acc_operations.o dbcsr_mm_3d.o dbcsr_mm_multrec.o dbcsr_mm_dist_operations.o dbcsr_mm_common.o dbcsr_multiply_api.o dbcsr_mm_hostdrv.o dbcsr_mm_types.o dbcsr_mm_cannon.o dbcsr_mm_sched.o dbcsr_mm.o dbcsr_mm_csr.o dbcsr_mm_accdrv.o dbcsr_index_operations.o dbcsr_block_access.o dbcsr_block_operations.o dbcsr_iterator_operations.o dbcsr_array_sort.o dbcsr_toollib.o dbcsr_btree.o dbcsr_string_utilities.o dbcsr_files.o dbcsr_blas_operations.o dbcsr_min_heap.o dbcsr_test_methods.o dbcsr_csr_conversions.o dbcsr_tests.o dbcsr_io.o dbcsr_transformations.o dbcsr_operations.o dbcsr_tas_util.o dbcsr_tas_types.o dbcsr_tas_test.o dbcsr_tas_reshape_ops.o dbcsr_tas_base.o dbcsr_tas_io.o dbcsr_tas_split.o dbcsr_tas_global.o dbcsr_tas_mm.o dbcsr_api.o dbcsr_tensor_api.o dbcsr_tensor_split.o dbcsr_tensor_reshape.o dbcsr_tensor_block.o dbcsr_allocate_wrap.o dbcsr_tensor_types.o dbcsr_tensor_index.o dbcsr_tensor_test.o dbcsr_tensor.o dbcsr_array_list_methods.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="\"Thu Oct 7 17:01:28 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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="\"Thu Oct 7 17:01:28 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 machine_internal.mod kinds.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="\"Thu Oct 7 17:01:28 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 machine_internal.mod kinds.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 machine.mod kinds.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="\"Thu Oct 7 17:01:29 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 machine.mod kinds.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="\"Thu Oct 7 17:01:29 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 memory_utilities.mod kinds.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="\"Thu Oct 7 17:01:31 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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="\"Thu Oct 7 17:01:32 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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="\"Thu Oct 7 17:01:33 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:01:33 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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="\"Thu Oct 7 17:01:33 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 machine.mod kinds.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="\"Thu Oct 7 17:01:34 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 machine.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_array_sort.mod' due to: cp_array_sort.o 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="\"Thu Oct 7 17:02:01 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 message_passing.mod kinds.mod util.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="\"Thu Oct 7 17:02:03 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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="\"Thu Oct 7 17:02:04 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 base_hooks.mod kinds.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="\"Thu Oct 7 17:02:05 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 'reference_manager.mod' due to: reference_manager.o true /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="\"Thu Oct 7 17:02:05 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 reference_manager.mod base_hooks.mod string_utilities.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="\"Thu Oct 7 17:02:37 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:02:41 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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="\"Thu Oct 7 17:02:47 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 machine.mod kinds.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="\"Thu Oct 7 17:02:48 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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="\"Thu Oct 7 17:02:49 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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="\"Thu Oct 7 17:02:49 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:02:49 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:02:51 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:02:51 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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="\"Thu Oct 7 17:02:52 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:02:52 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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="\"Thu Oct 7 17:02:53 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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="\"Thu Oct 7 17:02:53 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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_routinestat.mod list_callstackentry.mod callgraph.mod routine_map.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="\"Thu Oct 7 17:02:54 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_routinestat.mod list_callstackentry.mod callgraph.mod routine_map.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="\"Thu Oct 7 17:02:54 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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="\"Thu Oct 7 17:02:54 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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.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_callstackentry.mod list_timerenv.mod list_routinereport.mod list_routinestat.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="\"Thu Oct 7 17:02:55 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_callstackentry.mod list_timerenv.mod list_routinereport.mod list_routinestat.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cuda_profiling.mod' due to: cuda_profiling.o 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_types.mod timings_base_type.mod base_hooks.mod machine.mod callgraph.mod routine_map.mod list.mod kinds.mod cuda_profiling.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="\"Thu Oct 7 17:02:55 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_types.mod timings_base_type.mod base_hooks.mod machine.mod callgraph.mod routine_map.mod list.mod kinds.mod cuda_profiling.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_files.mod' due to: cp_files.o 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_iter_types.mod cp_para_types.mod base_hooks.mod string_utilities.mod machine.mod message_passing.mod timings.mod kinds.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="\"Thu Oct 7 17:02:56 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_iter_types.mod cp_para_types.mod base_hooks.mod string_utilities.mod machine.mod message_passing.mod timings.mod kinds.mod cp_files.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="\"Thu Oct 7 17:02:56 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 lebedev.mod mathconstants.mod machine.mod cp_log_handling.mod kinds.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="\"Thu Oct 7 17:02:59 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:03:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:03:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:541: update target 'cp_result_types.mod' due to: cp_result_types.o 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 message_passing.mod memory_utilities.mod kinds.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="\"Thu Oct 7 17:03:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:03:01 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 message_passing.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/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="\"Thu Oct 7 17:03:02 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:541: update target 'lapack.mod' due to: lapack.o true /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="\"Thu Oct 7 17:03:03 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:03:03 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 string_utilities.mod mathconstants.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/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="\"Thu Oct 7 17:03:05 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:03:07 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 string_utilities.mod kinds.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="\"Thu Oct 7 17:03:12 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 machine.mod cp_log_handling.mod message_passing.mod print_messages.mod timings.mod kinds.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="\"Thu Oct 7 17:03:20 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:03:21 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 message_passing.mod base_hooks.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="\"Thu Oct 7 17:03:21 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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="\"Thu Oct 7 17:03:21 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:03:23 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:03:23 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:03:24 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 message_passing.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/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="\"Thu Oct 7 17:03:24 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 string_utilities.mod kinds.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="\"Thu Oct 7 17:03:26 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 string_utilities.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_para_env.mod' due to: cp_para_env.o 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 machine.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/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="\"Thu Oct 7 17:03:27 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 machine.mod cp_log_handling.mod kinds.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 base_hooks.mod cp_para_env.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="\"Thu Oct 7 17:03:28 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 timings_types.mod cp_para_types.mod timings_base_type.mod util.mod base_hooks.mod message_passing.mod callgraph.mod routine_map.mod timings.mod list.mod kinds.mod cp_files.mod list_routinereport.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="\"Thu Oct 7 17:03:29 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:03:29 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:03:34 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a' due to: cp_array_sort.o whittaker.o reference_manager.o string_table.o cuda_profiling.o bibliography.o powell.o cp_result_types.o cp_files.o structure_factors.o cg_test.o list_routinestat.o physcon.o lapack.o routine_map.o cp_result_methods.o timings_base_type.o util.o print_messages.o t_sh_p_s_c.o string_utilities.o timings.o linear_systems.o d3_poly.o list_timerenv.o spherical_harmonics.o lebedev.o cp_units.o mathconstants.o mathlib.o timings_types.o periodic_table.o list.o cp_para_types.o cp_error_handling.o bessel_lib.o cp_para_env.o fparser.o gamma.o cp_iter_types.o callgraph.o eigenvalueproblems.o list_routinereport.o splines.o list_callstackentry.o memory_utilities.o t_c_g0.o distribution_1d_types.o cp_log_handling.o cp_array_utils.o structure_factor_types.o parallel_rng_types.o timings_report.o kahan_sum.o cp_min_heap.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 cp_array_sort.o whittaker.o reference_manager.o string_table.o cuda_profiling.o bibliography.o powell.o cp_result_types.o cp_files.o structure_factors.o cg_test.o list_routinestat.o physcon.o lapack.o routine_map.o cp_result_methods.o timings_base_type.o util.o print_messages.o t_sh_p_s_c.o string_utilities.o timings.o linear_systems.o d3_poly.o list_timerenv.o spherical_harmonics.o lebedev.o cp_units.o mathconstants.o mathlib.o timings_types.o periodic_table.o list.o cp_para_types.o cp_error_handling.o bessel_lib.o cp_para_env.o fparser.o gamma.o cp_iter_types.o callgraph.o eigenvalueproblems.o list_routinereport.o splines.o list_callstackentry.o memory_utilities.o t_c_g0.o distribution_1d_types.o cp_log_handling.o cp_array_utils.o structure_factor_types.o parallel_rng_types.o timings_report.o kahan_sum.o cp_min_heap.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_internal.o base_hooks.o machine.o kinds.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_internal.o base_hooks.o machine.o kinds.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:131: 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="\"Thu Oct 7 17:03:35 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 message_passing.mod machine.mod kinds.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="\"Thu Oct 7 17:03:35 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:127: 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="\"Thu Oct 7 17:03:36 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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/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 /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_replay.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:541: update target 'mathlib.mod' due to: mathlib.o 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 mathlib.mod mathconstants.mod cp_units.mod kinds.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="\"Thu Oct 7 17:03:36 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathlib.mod mathconstants.mod cp_units.mod kinds.mod true /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="\"Thu Oct 7 17:03:37 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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="\"Thu Oct 7 17:03:37 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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="\"Thu Oct 7 17:03:37 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_plan.mod fft_kinds.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="\"Thu Oct 7 17:03:38 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_plan.mod fft_kinds.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 base_hooks.mod fft_kinds.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="\"Thu Oct 7 17:03:38 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 base_hooks.mod fft_kinds.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="\"Thu Oct 7 17:03:50 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_plan.mod fft_kinds.mod fftw3_lib.mod fftsg_lib.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="\"Thu Oct 7 17:03:51 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_plan.mod fft_kinds.mod fftw3_lib.mod fftsg_lib.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="\"Thu Oct 7 17:03:51 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_log_handling.mod message_passing.mod fft_plan.mod kinds.mod fft_lib.mod fast.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="\"Thu Oct 7 17:03:52 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_log_handling.mod message_passing.mod fft_plan.mod kinds.mod fft_lib.mod fast.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 fft_tools.mod mathconstants.mod kinds.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="\"Thu Oct 7 17:04:06 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 fft_tools.mod mathconstants.mod kinds.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 mathlib.mod mathconstants.mod message_passing.mod pw_grid_info.mod kinds.mod util.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="\"Thu Oct 7 17:04:07 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathlib.mod mathconstants.mod message_passing.mod pw_grid_info.mod kinds.mod util.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 cp_log_handling.mod pw_grids.mod kinds.mod timings.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="\"Thu Oct 7 17:04:12 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_log_handling.mod pw_grids.mod kinds.mod timings.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_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_types.mod pw_grid_types.mod base_hooks.mod fft_tools.mod message_passing.mod kinds.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="\"Thu Oct 7 17:04:12 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_types.mod pw_grid_types.mod base_hooks.mod fft_tools.mod message_passing.mod kinds.mod fast.mod 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 cp_files.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/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="\"Thu Oct 7 17:04:13 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_files.mod base_hooks.mod kinds.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_types.mod pw_grid_types.mod base_hooks.mod fft_tools.mod machine.mod cp_log_handling.mod message_passing.mod kahan_sum.mod kinds.mod fast.mod pw_cuda.mod pw_fpga.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="\"Thu Oct 7 17:04:13 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_types.mod pw_grid_types.mod base_hooks.mod fft_tools.mod machine.mod cp_log_handling.mod message_passing.mod kahan_sum.mod kinds.mod fast.mod pw_cuda.mod pw_fpga.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_types.mod pw_grid_types.mod base_hooks.mod pw_methods.mod mathlib.mod machine.mod cp_log_handling.mod message_passing.mod pw_grids.mod cp_array_utils.mod kahan_sum.mod kinds.mod fast.mod util.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="\"Thu Oct 7 17:04:18 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_types.mod pw_grid_types.mod base_hooks.mod pw_methods.mod mathlib.mod machine.mod cp_log_handling.mod message_passing.mod pw_grids.mod cp_array_utils.mod kahan_sum.mod kinds.mod fast.mod util.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 mathlib.mod kinds.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="\"Thu Oct 7 17:04:26 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathlib.mod kinds.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 cell_types.mod realspace_grid_types.mod base_hooks.mod message_passing.mod cube_utils.mod kinds.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="\"Thu Oct 7 17:04:26 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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/cpu/grid_cpu_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_replay.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.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 /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_integrate.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/common/grid_buffer.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/cpu/grid_cpu_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.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/grid_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.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 /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_buffer.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_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/cpu/grid_prepare_pab_dgemm.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/cpu_private_header.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/cpu/tensor_local.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_context_cpu.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/hybrid/grid_hybrid_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/coefficients.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.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: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/cpu/grid_prepare_pab_dgemm.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/cpu_private_header.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/cpu/tensor_local.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_context_cpu.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.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/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.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:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridhybrid.a' due to: grid_integrate_hybrid.o grid_collocate_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_integrate_hybrid.o grid_collocate_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 '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/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/tensor_local.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/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.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 '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_prepare_pab_dgemm.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_cpu_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/tensor_local.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/non_orthorombic_corrections.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/coefficients.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_collocate_dgemm.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.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 '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/grid_cpu_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/cpu_private_header.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/cpu/tensor_local.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_context_cpu.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_collocate_dgemm.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.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 '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/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/tensor_local.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/non_orthorombic_corrections.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.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 '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/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/tensor_local.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/non_orthorombic_corrections.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.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: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/cpu/grid_prepare_pab_dgemm.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/tensor_local.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.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 '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/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/tensor_local.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.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 '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/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/tensor_local.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/non_orthorombic_corrections.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/coefficients.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/grid_collocate_dgemm.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.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 '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/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/tensor_local.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_buffer.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/cpu/utils.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:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcpu.a' due to: coefficients.o grid_collocate_dgemm.o grid_context_cpu.o non_orthorombic_corrections.o collocation_integration.o grid_prepare_pab_dgemm.o tensor_local.o grid_integrate_dgemm.o utils.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 coefficients.o grid_collocate_dgemm.o grid_context_cpu.o non_orthorombic_corrections.o collocation_integration.o grid_prepare_pab_dgemm.o tensor_local.o grid_integrate_dgemm.o utils.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_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_common.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_constants.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 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_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/common/grid_common.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_constants.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/common/grid_basis_set.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_task_list.h /build/cp2k-Q381vr/cp2k-8.1/src/grid/ref/grid_ref_collocate.h /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/ref/grid_ref_task_list.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/common/grid_common.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_constants.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_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_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_integrate.o grid_ref_prepare_pab.o grid_ref_task_list.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_integrate.o grid_ref_prepare_pab.o grid_ref_task_list.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_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_constants.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/common/grid_library.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_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_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_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 /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/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_buffer.o grid_sphere_cache.o grid_basis_set.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_buffer.o grid_sphere_cache.o grid_basis_set.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="\"Thu Oct 7 17:04:42 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:541: update target 'shell_potential_types.mod' due to: shell_potential_types.o /build/cp2k-Q381vr/cp2k-8.1/src/subsys/shell_potential_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_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 string_utilities.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/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="\"Thu Oct 7 17:04:42 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 string_utilities.mod cp_log_handling.mod kinds.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="\"Thu Oct 7 17:04:43 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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="\"Thu Oct 7 17:04:43 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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 kinds.mod base_hooks.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="\"Thu Oct 7 17:04:43 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 kinds.mod base_hooks.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="\"Thu Oct 7 17:04:44 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_parser_buffer_types.mod cp_parser_ilist_types.mod cp_para_types.mod cp_parser_status_types.mod cp_parser_inpp_types.mod base_hooks.mod string_utilities.mod message_passing.mod kinds.mod cp_files.mod cp_para_env.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="\"Thu Oct 7 17:04:44 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_parser_buffer_types.mod cp_parser_ilist_types.mod cp_para_types.mod cp_parser_status_types.mod cp_parser_inpp_types.mod base_hooks.mod string_utilities.mod message_passing.mod kinds.mod cp_files.mod cp_para_env.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 cp_units.mod kinds.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="\"Thu Oct 7 17:04:45 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_units.mod kinds.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_val_types.mod input_enumeration_types.mod base_hooks.mod string_utilities.mod reference_manager.mod print_messages.mod cp_units.mod kinds.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="\"Thu Oct 7 17:04:46 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_val_types.mod input_enumeration_types.mod base_hooks.mod string_utilities.mod reference_manager.mod print_messages.mod cp_units.mod kinds.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/common/cp_linked_list.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 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="\"Thu Oct 7 17:04:49 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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/common/cp_linked_list.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 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_val_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod cp_log_handling.mod reference_manager.mod print_messages.mod cp_linked_list_input.mod kinds.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="\"Thu Oct 7 17:04:50 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_val_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod cp_log_handling.mod reference_manager.mod print_messages.mod cp_linked_list_input.mod kinds.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="\"Thu Oct 7 17:04:54 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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="\"Thu Oct 7 17:04:55 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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 orbital_symbols.mod mathlib.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/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="\"Thu Oct 7 17:04:55 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 orbital_symbols.mod mathlib.mod mathconstants.mod kinds.mod orbital_pointers.mod 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 orbital_transformation_matrices.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/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="\"Thu Oct 7 17:04:57 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 orbital_transformation_matrices.mod mathconstants.mod kinds.mod orbital_pointers.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 '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="\"Thu Oct 7 17:04:57 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 string_utilities.mod cp_log_handling.mod memory_utilities.mod kinds.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="\"Thu Oct 7 17:04:58 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 string_utilities.mod cp_log_handling.mod memory_utilities.mod kinds.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_parser_buffer_types.mod cp_para_types.mod cp_parser_types.mod base_hooks.mod cp_parser_ilist_methods.mod string_utilities.mod cp_log_handling.mod message_passing.mod cp_parser_inpp_methods.mod kinds.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="\"Thu Oct 7 17:04:59 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_parser_buffer_types.mod cp_para_types.mod cp_parser_types.mod base_hooks.mod cp_parser_ilist_methods.mod string_utilities.mod cp_log_handling.mod message_passing.mod cp_parser_inpp_methods.mod kinds.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 '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 input_val_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod mathlib.mod orbital_pointers.mod mathconstants.mod orbital_transformation_matrices.mod ao_util.mod string_utilities.mod memory_utilities.mod cp_linked_list_input.mod bibliography.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/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="\"Thu Oct 7 17:05:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 'external_potential_types.mod' due to: external_potential_types.o /build/cp2k-Q381vr/cp2k-8.1/src/subsys/external_potential_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod mathlib.mod orbital_pointers.mod mathconstants.mod orbital_transformation_matrices.mod ao_util.mod string_utilities.mod memory_utilities.mod cp_linked_list_input.mod bibliography.mod kinds.mod cp_parser_methods.mod periodic_table.mod true /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="\"Thu Oct 7 17:05:08 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:541: update target 'damping_dipole_types.mod' due to: damping_dipole_types.o /build/cp2k-Q381vr/cp2k-8.1/src/subsys/damping_dipole_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 '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 shell_potential_types.mod external_potential_types.mod damping_dipole_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="\"Thu Oct 7 17:05:08 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 message_passing.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/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="\"Thu Oct 7 17:05:09 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 message_passing.mod base_hooks.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 input_section_types.mod particle_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="\"Thu Oct 7 17:05:09 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_section_types.mod particle_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="\"Thu Oct 7 17:05:15 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_iter_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod machine.mod cp_log_handling.mod message_passing.mod memory_utilities.mod kinds.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="\"Thu Oct 7 17:05:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_iter_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod machine.mod cp_log_handling.mod message_passing.mod memory_utilities.mod kinds.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 atomic_kind_types.mod cell_types.mod shell_potential_types.mod input_section_types.mod force_field_kind_types.mod base_hooks.mod cp_log_handling.mod cp_output_handling.mod kinds.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="\"Thu Oct 7 17:05:17 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 atomic_kind_types.mod cell_types.mod shell_potential_types.mod input_section_types.mod force_field_kind_types.mod base_hooks.mod cp_log_handling.mod cp_output_handling.mod kinds.mod true /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="\"Thu Oct 7 17:05:19 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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="\"Thu Oct 7 17:05:19 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:05:19 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 colvar_types.mod molecule_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/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="\"Thu Oct 7 17:05:20 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 colvar_types.mod molecule_kind_types.mod base_hooks.mod kinds.mod true /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 particle_types.mod atomic_kind_types.mod input_section_types.mod external_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/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="\"Thu Oct 7 17:05:21 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:541: update target 'multipole_types.mod' due to: multipole_types.o /build/cp2k-Q381vr/cp2k-8.1/src/subsys/multipole_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod atomic_kind_types.mod input_section_types.mod external_potential_types.mod base_hooks.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'virial_types.mod' due to: virial_types.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'molecule_kind_list_types.mod' due to: molecule_kind_list_types.o true /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="\"Thu Oct 7 17:05:21 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:541: update target 'atprop_types.mod' due to: atprop_types.o /build/cp2k-Q381vr/cp2k-8.1/src/subsys/atprop_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 'distribution_1d_types.mod' due to: distribution_1d_types.o 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="\"Thu Oct 7 17:05:22 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:541: update target 'molecule_list_types.mod' due to: molecule_list_types.o /build/cp2k-Q381vr/cp2k-8.1/src/subsys/molecule_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_types.mod base_hooks.mod 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="\"Thu Oct 7 17:05:22 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod multipole_types.mod cp_para_types.mod colvar_types.mod molecule_kind_types.mod virial_types.mod molecule_kind_list_types.mod atprop_types.mod atomic_kind_list_types.mod distribution_1d_types.mod molecule_list_types.mod particle_list_types.mod cp_result_types.mod base_hooks.mod kinds.mod cp_para_env.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="\"Thu Oct 7 17:05:22 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: atomic_kind_types.o molecule_kind_list_types.o particle_types.o atomic_kind_list_types.o virial_types.o shell_potential_types.o external_potential_types.o cp_subsys_types.o force_field_kind_types.o molecule_types.o colvar_types.o cell_types.o damping_dipole_types.o molecule_list_types.o multipole_types.o atprop_types.o particle_list_types.o molecule_kind_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 atomic_kind_types.o molecule_kind_list_types.o particle_types.o atomic_kind_list_types.o virial_types.o shell_potential_types.o external_potential_types.o cp_subsys_types.o force_field_kind_types.o molecule_types.o colvar_types.o cell_types.o damping_dipole_types.o molecule_list_types.o multipole_types.o atprop_types.o particle_list_types.o molecule_kind_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="\"Thu Oct 7 17:05:24 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 base_hooks.mod mathlib.mod machine.mod message_passing.mod cp_array_utils.mod cp_blacs_calls.mod kinds.mod cp_para_env.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="\"Thu Oct 7 17:05:24 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 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 base_hooks.mod machine.mod cp_log_handling.mod message_passing.mod cp_blacs_env.mod kinds.mod cp_para_env.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="\"Thu Oct 7 17:05:24 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 base_hooks.mod machine.mod cp_log_handling.mod message_passing.mod cp_blacs_env.mod kinds.mod cp_para_env.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_log_handling.mod message_passing.mod cp_blacs_calls.mod cp_blacs_env.mod cp_fm_struct.mod kinds.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="\"Thu Oct 7 17:05:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_log_handling.mod message_passing.mod cp_blacs_calls.mod cp_blacs_env.mod cp_fm_struct.mod kinds.mod true /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 base_hooks.mod mathlib.mod cp_log_handling.mod message_passing.mod kinds.mod cp_blacs_env.mod cp_fm_struct.mod cp_para_env.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="\"Thu Oct 7 17:05:30 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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="\"Thu Oct 7 17:05:30 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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/common/cp_linked_list.fypp /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_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="\"Thu Oct 7 17:05:30 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 mathconstants.mod cp_log_handling.mod message_passing.mod cp_blacs_calls.mod kinds.mod cp_blacs_env.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_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="\"Thu Oct 7 17:05:31 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_cfm_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_types.mod base_hooks.mod mathconstants.mod cp_log_handling.mod message_passing.mod cp_blacs_calls.mod kinds.mod cp_blacs_env.mod cp_fm_struct.mod 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 mathconstants.mod message_passing.mod kahan_sum.mod kinds.mod cp_blacs_env.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_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="\"Thu Oct 7 17:05:34 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_linked_list_fm.mod' due to: cp_linked_list_fm.o 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 base_hooks.mod cp_log_handling.mod cp_linked_list_fm.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="\"Thu Oct 7 17:05:36 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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 mathlib.mod machine.mod cp_log_handling.mod message_passing.mod kahan_sum.mod kinds.mod cp_blacs_env.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_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="\"Thu Oct 7 17:05:36 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_diag_utils.mod' due to: cp_fm_diag_utils.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'cp_fm_basic_linalg.mod' due to: cp_fm_basic_linalg.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 machine.mod cp_log_handling.mod message_passing.mod cp_fm_diag_utils.mod cp_fm_basic_linalg.mod kinds.mod cp_blacs_env.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_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="\"Thu Oct 7 17:05:38 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 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 cp_blacs_env.mod kinds.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="\"Thu Oct 7 17:05:39 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:541: update target 'cp_fm_cholesky.mod' due to: cp_fm_cholesky.o /build/cp2k-Q381vr/cp2k-8.1/src/fm/cp_fm_cholesky.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod cp_log_handling.mod cp_blacs_env.mod kinds.mod 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_fm_elpa.mod base_hooks.mod machine.mod cp_log_handling.mod message_passing.mod cp_blacs_calls.mod cp_fm_diag_utils.mod cp_fm_cholesky.mod cp_fm_basic_linalg.mod kinds.mod cp_blacs_env.mod cp_fm_struct.mod cp_para_env.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="\"Thu Oct 7 17:05:39 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 cp_cfm_basic_linalg.mod kinds.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="\"Thu Oct 7 17:05:40 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_blacs_env.o cp_blacs_calls.o cp_fm_diag_utils.o cp_fm_vect.o cp_fm_struct.o cp_linked_list_fm.o cp_fm_types.o cp_cfm_basic_linalg.o cp_fm_pool_types.o cp_fm_basic_linalg.o cp_fm_elpa.o cp_fm_diag.o cp_fm_cholesky.o cp_cfm_diag.o cp_cfm_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_blacs_env.o cp_blacs_calls.o cp_fm_diag_utils.o cp_fm_vect.o cp_fm_struct.o cp_linked_list_fm.o cp_fm_types.o cp_cfm_basic_linalg.o cp_fm_pool_types.o cp_fm_basic_linalg.o cp_fm_elpa.o cp_fm_diag.o cp_fm_cholesky.o cp_cfm_diag.o cp_cfm_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: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 kinds.mod base_hooks.mod orbital_pointers.mod gamma.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="\"Thu Oct 7 17:05:41 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 kinds.mod base_hooks.mod orbital_pointers.mod gamma.mod true /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 orbital_transformation_matrices.mod mathconstants.mod kinds.mod ai_os_rr.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="\"Thu Oct 7 17:05:43 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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 kinds.mod base_hooks.mod mathconstants.mod gamma.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="\"Thu Oct 7 17:05:49 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 mathconstants.mod gamma.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_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="\"Thu Oct 7 17:05:49 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:05:53 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 mathconstants.mod gamma.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_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="\"Thu Oct 7 17:05:54 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathconstants.mod gamma.mod kinds.mod orbital_pointers.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 input_val_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod orbital_symbols.mod orbital_pointers.mod mathconstants.mod orbital_transformation_matrices.mod string_utilities.mod memory_utilities.mod sto_ng.mod cp_linked_list_input.mod bibliography.mod kinds.mod ai_coulomb.mod cp_parser_methods.mod util.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="\"Thu Oct 7 17:06:05 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_val_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod orbital_symbols.mod orbital_pointers.mod mathconstants.mod orbital_transformation_matrices.mod string_utilities.mod memory_utilities.mod sto_ng.mod cp_linked_list_input.mod bibliography.mod kinds.mod ai_coulomb.mod cp_parser_methods.mod util.mod true /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 orbital_symbols.mod lapack.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/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="\"Thu Oct 7 17:06:20 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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 orbital_pointers.mod kinds.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="\"Thu Oct 7 17:06:21 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:541: update target 'ai_derivatives.mod' due to: ai_derivatives.o /build/cp2k-Q381vr/cp2k-8.1/src/aobasis/ai_derivatives.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod orbital_pointers.mod kinds.mod 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 ai_derivatives.mod mathconstants.mod ai_overlap.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_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="\"Thu Oct 7 17:06:23 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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 machine.mod kinds.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="\"Thu Oct 7 17:06:30 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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 orbital_pointers.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_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="\"Thu Oct 7 17:06:31 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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="\"Thu Oct 7 17:06:31 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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 orbital_pointers.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.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="\"Thu Oct 7 17:06:31 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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 orbital_pointers.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_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="\"Thu Oct 7 17:06:39 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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 mathconstants.mod kinds.mod ai_os_rr.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="\"Thu Oct 7 17:06:44 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:06:46 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 mathconstants.mod t_c_g0.mod gamma.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_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="\"Thu Oct 7 17:06:46 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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 orbital_pointers.mod kinds.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="\"Thu Oct 7 17:06:48 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 mathconstants.mod kinds.mod ai_os_rr.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="\"Thu Oct 7 17:06:53 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 mathconstants.mod ai_oneelectron.mod kinds.mod ai_overlap_debug.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_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="\"Thu Oct 7 17:06:53 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 orbital_pointers.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_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="\"Thu Oct 7 17:06:55 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 mathconstants.mod kinds.mod ai_os_rr.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="\"Thu Oct 7 17:06:57 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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="\"Thu Oct 7 17:06:58 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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="\"Thu Oct 7 17:07:01 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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 mathconstants.mod kinds.mod ai_os_rr.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="\"Thu Oct 7 17:07:01 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 orbital_symbols.mod ao_util.mod memory_utilities.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/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="\"Thu Oct 7 17:07:02 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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="\"Thu Oct 7 17:07:03 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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="\"Thu Oct 7 17:07:06 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kao.a' due to: orbital_symbols.o ai_overlap.o ai_eri_debug.o ai_verfc.o aux_basis_set.o ai_moments.o ai_coulomb_test.o orbital_transformation_matrices.o ai_fermi_contact.o ai_overlap_debug.o ao_util.o ai_coulomb.o ai_overlap3.o basis_set_types.o ai_angmom.o ai_elec_field.o basis_set_container_types.o orbital_pointers.o sto_ng.o ai_operators_r12.o ai_oneelectron.o ai_operator_ra2m.o ai_overlap_ppl.o ai_derivatives.o ai_overlap_aabb.o ai_spin_orbit.o ai_os_rr.o ai_contraction_sphi.o ai_overlap3_debug.o ai_kinetic.o soft_basis_set.o ai_contraction.o ai_onecenter.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 orbital_symbols.o ai_overlap.o ai_eri_debug.o ai_verfc.o aux_basis_set.o ai_moments.o ai_coulomb_test.o orbital_transformation_matrices.o ai_fermi_contact.o ai_overlap_debug.o ao_util.o ai_coulomb.o ai_overlap3.o basis_set_types.o ai_angmom.o ai_elec_field.o basis_set_container_types.o orbital_pointers.o sto_ng.o ai_operators_r12.o ai_oneelectron.o ai_operator_ra2m.o ai_overlap_ppl.o ai_derivatives.o ai_overlap_aabb.o ai_spin_orbit.o ai_os_rr.o ai_contraction_sphi.o ai_overlap3_debug.o ai_kinetic.o soft_basis_set.o ai_contraction.o ai_onecenter.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_enumeration_types.mod input_section_types.mod input_keyword_types.mod cp_parser_types.mod base_hooks.mod string_utilities.mod cp_log_handling.mod cp_units.mod cp_linked_list_input.mod kinds.mod cp_parser_methods.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="\"Thu Oct 7 17:07:07 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_inpp_types.o input_parsing.o input_section_types.o cp_output_handling.o input_keyword_types.o cp_parser_methods.o cp_parser_inpp_methods.o cp_parser_ilist_methods.o cp_parser_status_types.o input_enumeration_types.o cp_parser_types.o cp_parser_buffer_types.o input_val_types.o cp_linked_list_input.o cp_parser_ilist_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_inpp_types.o input_parsing.o input_section_types.o cp_output_handling.o input_keyword_types.o cp_parser_methods.o cp_parser_inpp_methods.o cp_parser_ilist_methods.o cp_parser_status_types.o input_enumeration_types.o cp_parser_types.o cp_parser_buffer_types.o input_val_types.o cp_linked_list_input.o cp_parser_ilist_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 '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="\"Thu Oct 7 17:07:09 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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/common/cp_linked_list.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_types.mod realspace_grid_types.mod base_hooks.mod cp_array_utils.mod kinds.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="\"Thu Oct 7 17:07:10 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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/common/cp_linked_list.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_types.mod realspace_grid_types.mod base_hooks.mod cp_array_utils.mod kinds.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_types.mod pw_grid_types.mod base_hooks.mod pw_methods.mod cp_log_handling.mod pw_grids.mod cp_linked_list_pw.mod timings.mod kinds.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="\"Thu Oct 7 17:07:11 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_types.mod pw_grid_types.mod base_hooks.mod pw_methods.mod cp_log_handling.mod pw_grids.mod cp_linked_list_pw.mod timings.mod kinds.mod true /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="\"Thu Oct 7 17:07:12 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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="\"Thu Oct 7 17:07:12 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 'lazy.mod' due to: lazy.o 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 lazy.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/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="\"Thu Oct 7 17:07:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 'dirichlet_bc_types.mod' due to: dirichlet_bc_types.o 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="\"Thu Oct 7 17:07:17 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:541: update target 'dielectric_types.mod' due to: dielectric_types.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/dielectric_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 '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_types.mod pw_grid_types.mod base_hooks.mod message_passing.mod pw_grids.mod kinds.mod fast.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="\"Thu Oct 7 17:07:17 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 'dct.mod' due to: dct.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/dct.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_types.mod pw_grid_types.mod base_hooks.mod message_passing.mod pw_grids.mod kinds.mod fast.mod 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="\"Thu Oct 7 17:07:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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="\"Thu Oct 7 17:07:26 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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_pool_types.mod pw_types.mod pw_grid_types.mod base_hooks.mod pw_methods.mod mathconstants.mod bibliography.mod kinds.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="\"Thu Oct 7 17:07:26 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_pool_types.mod pw_types.mod pw_grid_types.mod base_hooks.mod pw_methods.mod mathconstants.mod bibliography.mod kinds.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 '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 dirichlet_bc_types.mod pw_pool_types.mod pw_types.mod ps_implicit_types.mod ps_wavelet_types.mod pw_grid_types.mod realspace_grid_types.mod dielectric_types.mod base_hooks.mod mathconstants.mod pw_grids.mod mt_util.mod kinds.mod bessel_lib.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="\"Thu Oct 7 17:07:27 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 dirichlet_bc_types.mod pw_pool_types.mod pw_types.mod ps_implicit_types.mod ps_wavelet_types.mod pw_grid_types.mod realspace_grid_types.mod dielectric_types.mod base_hooks.mod mathconstants.mod pw_grids.mod mt_util.mod kinds.mod bessel_lib.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ps_wavelet_fft3d.mod' due to: ps_wavelet_fft3d.o 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 message_passing.mod base_hooks.mod ps_wavelet_fft3d.mod kinds.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="\"Thu Oct 7 17:07:28 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 message_passing.mod base_hooks.mod ps_wavelet_fft3d.mod kinds.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 ps_wavelet_fft3d.mod mathconstants.mod ps_wavelet_base.mod kinds.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="\"Thu Oct 7 17:07:33 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 ps_wavelet_fft3d.mod mathconstants.mod ps_wavelet_base.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'ps_wavelet_scaling_function.mod' due to: ps_wavelet_scaling_function.o 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 base_hooks.mod ps_wavelet_fft3d.mod ps_wavelet_util.mod message_passing.mod ps_wavelet_base.mod kinds.mod ps_wavelet_scaling_function.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="\"Thu Oct 7 17:07:34 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:541: update target 'ps_wavelet_kernel.mod' due to: ps_wavelet_kernel.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_kernel.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod ps_wavelet_fft3d.mod ps_wavelet_util.mod message_passing.mod ps_wavelet_base.mod kinds.mod ps_wavelet_scaling_function.mod 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_poisson_types.mod pw_types.mod ps_wavelet_types.mod pw_grid_types.mod base_hooks.mod ps_wavelet_util.mod message_passing.mod ps_wavelet_kernel.mod bibliography.mod kinds.mod 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="\"Thu Oct 7 17:07:38 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:541: update target 'ps_wavelet_methods.mod' due to: ps_wavelet_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_wavelet_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod pw_types.mod ps_wavelet_types.mod pw_grid_types.mod base_hooks.mod ps_wavelet_util.mod message_passing.mod ps_wavelet_kernel.mod bibliography.mod kinds.mod util.mod true /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_pool_types.mod pw_types.mod realspace_grid_types.mod pw_grid_types.mod base_hooks.mod pw_methods.mod kinds.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="\"Thu Oct 7 17:07:40 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 'rs_methods.mod' due to: rs_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/rs_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod pw_types.mod realspace_grid_types.mod pw_grid_types.mod base_hooks.mod pw_methods.mod kinds.mod 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_pool_types.mod pw_types.mod realspace_grid_types.mod pw_grid_types.mod dielectric_types.mod base_hooks.mod pw_methods.mod mathconstants.mod rs_methods.mod kinds.mod dct.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="\"Thu Oct 7 17:07:42 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 /build/cp2k-Q381vr/cp2k-8.1/src/pw/dielectric_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod pw_types.mod realspace_grid_types.mod pw_grid_types.mod dielectric_types.mod base_hooks.mod pw_methods.mod mathconstants.mod rs_methods.mod kinds.mod dct.mod 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_poisson_types.mod dirichlet_bc_types.mod pw_pool_types.mod pw_types.mod ps_implicit_types.mod pw_grid_types.mod pw_methods.mod base_hooks.mod mathlib.mod mathconstants.mod cp_log_handling.mod message_passing.mod rs_methods.mod kinds.mod physcon.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="\"Thu Oct 7 17:07:45 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_poisson_types.mod dirichlet_bc_types.mod pw_pool_types.mod pw_types.mod ps_implicit_types.mod pw_grid_types.mod pw_methods.mod base_hooks.mod mathlib.mod mathconstants.mod cp_log_handling.mod message_passing.mod rs_methods.mod kinds.mod physcon.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_poisson_types.mod dirichlet_bc_types.mod pw_pool_types.mod pw_types.mod ps_implicit_types.mod pw_grid_types.mod dielectric_types.mod pw_methods.mod base_hooks.mod mathconstants.mod cp_log_handling.mod message_passing.mod dielectric_methods.mod kahan_sum.mod dirichlet_bc_methods.mod bibliography.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_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="\"Thu Oct 7 17:07:51 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 /build/cp2k-Q381vr/cp2k-8.1/src/pw/ps_implicit_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod dirichlet_bc_types.mod pw_pool_types.mod pw_types.mod ps_implicit_types.mod pw_grid_types.mod dielectric_types.mod pw_methods.mod base_hooks.mod mathconstants.mod cp_log_handling.mod message_passing.mod dielectric_methods.mod kahan_sum.mod dirichlet_bc_methods.mod bibliography.mod kinds.mod dct.mod 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_poisson_types.mod pw_pool_types.mod pw_types.mod ps_implicit_types.mod ps_wavelet_types.mod pw_grid_types.mod pw_methods.mod base_hooks.mod ps_wavelet_methods.mod mathconstants.mod cp_log_handling.mod pw_grids.mod mt_util.mod dielectric_methods.mod ps_implicit_methods.mod kinds.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="\"Thu Oct 7 17:08:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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_pool_types.mod pw_types.mod pw_grid_types.mod base_hooks.mod pw_methods.mod mathconstants.mod cp_log_handling.mod message_passing.mod kinds.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="\"Thu Oct 7 17:08:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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_poisson_types.mod pw_types.mod pw_grid_types.mod pw_methods.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/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="\"Thu Oct 7 17:08:10 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:541: update target 'dg_rho0_types.mod' due to: dg_rho0_types.o /build/cp2k-Q381vr/cp2k-8.1/src/pw/dg_rho0_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod pw_types.mod pw_grid_types.mod pw_methods.mod base_hooks.mod kinds.mod 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="\"Thu Oct 7 17:08:10 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_types.mod pw_grid_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod kinds.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="\"Thu Oct 7 17:08:10 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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_types.mod realspace_grid_types.mod pw_grid_types.mod base_hooks.mod fft_tools.mod mathlib.mod pw_grids.mod structure_factors.mod pw_grid_info.mod kinds.mod fast.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="\"Thu Oct 7 17:08:13 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:519: update target '/build/cp2k-Q381vr/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw.a' due to: lazy.o pw_fpga.o dirichlet_bc_types.o pw_grid_types.o ps_wavelet_fft3d.o pw_pool_types.o pw_types.o ps_wavelet_scaling_function.o cp_linked_list_pw.o pw_poisson_methods.o ps_wavelet_kernel.o ps_implicit_methods.o mt_util.o pw_spline_utils.o dg_types.o dielectric_methods.o fft_tools.o ps_wavelet_types.o ps_wavelet_util.o rs_methods.o pw_grids.o cube_utils.o dct.o realspace_grid_cube.o fast.o pw_poisson_types.o dgs.o dielectric_types.o dirichlet_bc_methods.o ps_wavelet_base.o pw_methods.o pw_cuda.o realspace_grid_types.o pw_grid_info.o ps_implicit_types.o ps_wavelet_methods.o dg_rho0_types.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 lazy.o pw_fpga.o dirichlet_bc_types.o pw_grid_types.o ps_wavelet_fft3d.o pw_pool_types.o pw_types.o ps_wavelet_scaling_function.o cp_linked_list_pw.o pw_poisson_methods.o ps_wavelet_kernel.o ps_implicit_methods.o mt_util.o pw_spline_utils.o dg_types.o dielectric_methods.o fft_tools.o ps_wavelet_types.o ps_wavelet_util.o rs_methods.o pw_grids.o cube_utils.o dct.o realspace_grid_cube.o fast.o pw_poisson_types.o dgs.o dielectric_types.o dirichlet_bc_methods.o ps_wavelet_base.o pw_methods.o pw_cuda.o realspace_grid_types.o pw_grid_info.o ps_implicit_types.o ps_wavelet_methods.o dg_rho0_types.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: fftw3_lib.o fft_plan.o fft_kinds.o mltfftsg_tools.o fft_lib.o fftsg_lib.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 fftw3_lib.o fft_plan.o fft_kinds.o mltfftsg_tools.o fft_lib.o fftsg_lib.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:147: 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="\"Thu Oct 7 17:08:15 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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/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 /build/cp2k-Q381vr/cp2k-8.1/src/grid/grid_replay.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:143: 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="\"Thu Oct 7 17:08:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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="\"Thu Oct 7 17:08:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 string_utilities.mod graph_utils.mod memory_utilities.mod kinds.mod cp_files.mod physcon.mod periodic_table.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="\"Thu Oct 7 17:08:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 string_utilities.mod graph_utils.mod memory_utilities.mod kinds.mod cp_files.mod physcon.mod periodic_table.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 graph_methods.mod base_hooks.mod mathconstants.mod graph_utils.mod kinds.mod cp_files.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="\"Thu Oct 7 17:08:22 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:135: 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="\"Thu Oct 7 17:08:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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="\"Thu Oct 7 17:08:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:08:29 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 input_constants.mod kinds.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="\"Thu Oct 7 17:08:30 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_constants.mod kinds.mod 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 machine.mod cp_blacs_env.mod kinds.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="\"Thu Oct 7 17:08:30 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 machine.mod cp_blacs_env.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_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="\"Thu Oct 7 17:08:30 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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="\"Thu Oct 7 17:08:31 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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="\"Thu Oct 7 17:08:31 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 basis_set_types.mod dg_types.mod pw_pool_types.mod semi_empirical_mpole_types.mod input_section_types.mod semi_empirical_expns3_types.mod multipole_types.mod taper_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod cp_output_handling.mod kinds.mod physcon.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="\"Thu Oct 7 17:08:31 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 basis_set_types.mod dg_types.mod pw_pool_types.mod semi_empirical_mpole_types.mod input_section_types.mod semi_empirical_expns3_types.mod multipole_types.mod taper_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod cp_output_handling.mod kinds.mod physcon.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 input_constants.mod kinds.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="\"Thu Oct 7 17:08:33 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_constants.mod kinds.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 qs_cdft_opt_types.mod input_section_types.mod base_hooks.mod input_constants.mod kinds.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="\"Thu Oct 7 17:08:33 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_cdft_opt_types.mod input_section_types.mod base_hooks.mod input_constants.mod kinds.mod 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 input_constants.mod kinds.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="\"Thu Oct 7 17:08:33 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_constants.mod kinds.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 qs_cdft_opt_types.mod pw_types.mod outer_scf_control_types.mod cp_fm_types.mod hirshfeld_types.mod base_hooks.mod input_constants.mod cp_array_utils.mod kinds.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="\"Thu Oct 7 17:08:34 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_cdft_opt_types.mod pw_types.mod outer_scf_control_types.mod cp_fm_types.mod hirshfeld_types.mod base_hooks.mod input_constants.mod cp_array_utils.mod kinds.mod true /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="\"Thu Oct 7 17:08:35 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 base_hooks.mod memory_utilities.mod kinds.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="\"Thu Oct 7 17:08:36 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 base_hooks.mod memory_utilities.mod kinds.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 input_constants.mod cp_log_handling.mod memory_utilities.mod cp_output_handling.mod kinds.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="\"Thu Oct 7 17:08:39 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_constants.mod cp_log_handling.mod memory_utilities.mod cp_output_handling.mod kinds.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 cp_fm_types.mod pair_potential_types.mod base_hooks.mod input_constants.mod xas_control.mod kinds.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="\"Thu Oct 7 17:08:39 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_fm_types.mod pair_potential_types.mod base_hooks.mod input_constants.mod xas_control.mod kinds.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 mathlib.mod mathconstants.mod cp_log_handling.mod orbital_transformation_matrices.mod ao_util.mod memory_utilities.mod cp_output_handling.mod kinds.mod orbital_pointers.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="\"Thu Oct 7 17:08:41 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathlib.mod mathconstants.mod cp_log_handling.mod orbital_transformation_matrices.mod ao_util.mod memory_utilities.mod cp_output_handling.mod kinds.mod orbital_pointers.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 cp_output_handling.mod kinds.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="\"Thu Oct 7 17:08:45 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_output_handling.mod kinds.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 '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="\"Thu Oct 7 17:08:46 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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 util.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_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="\"Thu Oct 7 17:08:46 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 util.mod 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="\"Thu Oct 7 17:08:47 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:08:48 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 lebedev.mod mathconstants.mod input_constants.mod memory_utilities.mod kinds.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="\"Thu Oct 7 17:08:49 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 lebedev.mod mathconstants.mod input_constants.mod memory_utilities.mod kinds.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 input_section_types.mod cp_parser_types.mod atom_upf.mod base_hooks.mod string_utilities.mod input_constants.mod mathconstants.mod qs_grid_atom.mod cp_linked_list_input.mod bibliography.mod kinds.mod bessel_lib.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_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="\"Thu Oct 7 17:08:53 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_section_types.mod cp_parser_types.mod atom_upf.mod base_hooks.mod string_utilities.mod input_constants.mod mathconstants.mod qs_grid_atom.mod cp_linked_list_input.mod bibliography.mod kinds.mod bessel_lib.mod cp_parser_methods.mod periodic_table.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 lebedev.mod orbital_transformation_matrices.mod memory_utilities.mod kinds.mod spherical_harmonics.mod orbital_pointers.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="\"Thu Oct 7 17:08:59 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 lebedev.mod orbital_transformation_matrices.mod memory_utilities.mod kinds.mod spherical_harmonics.mod orbital_pointers.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="\"Thu Oct 7 17:09:01 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathlib.mod mathconstants.mod semi_empirical_int_arrays.mod kinds.mod physcon.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="\"Thu Oct 7 17:09:03 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathlib.mod mathconstants.mod semi_empirical_int_arrays.mod kinds.mod physcon.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 input_constants.mod semi_empirical_par_utils.mod kinds.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="\"Thu Oct 7 17:09:04 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_constants.mod semi_empirical_par_utils.mod kinds.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 input_constants.mod semi_empirical_par_utils.mod semi_empirical_int_arrays.mod kinds.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="\"Thu Oct 7 17:09:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_constants.mod semi_empirical_par_utils.mod semi_empirical_int_arrays.mod kinds.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 cp_control_types.mod cell_types.mod input_section_types.mod semi_empirical_types.mod base_hooks.mod semi_empirical_parameters.mod input_constants.mod semi_empirical_par_utils.mod semi_empirical_mpole_methods.mod kinds.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="\"Thu Oct 7 17:09:26 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_control_types.mod cell_types.mod input_section_types.mod semi_empirical_types.mod base_hooks.mod semi_empirical_parameters.mod input_constants.mod semi_empirical_par_utils.mod semi_empirical_mpole_methods.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 input_val_types.mod basis_set_types.mod cp_control_types.mod xtb_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod string_utilities.mod physcon.mod cp_linked_list_input.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/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="\"Thu Oct 7 17:09:26 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_val_types.mod basis_set_types.mod cp_control_types.mod xtb_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod string_utilities.mod physcon.mod cp_linked_list_input.mod kinds.mod cp_parser_methods.mod periodic_table.mod 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:541: update target 'splines.mod' due to: splines.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 base_hooks.mod string_utilities.mod lapack.mod orbital_transformation_matrices.mod ao_util.mod ai_overlap.mod kinds.mod cp_files.mod input_constants.mod kahan_sum.mod physcon.mod periodic_table.mod mathconstants.mod ai_onecenter.mod qs_grid_atom.mod orbital_pointers.mod mathlib.mod splines.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="\"Thu Oct 7 17:09:27 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 base_hooks.mod string_utilities.mod lapack.mod orbital_transformation_matrices.mod ao_util.mod ai_overlap.mod kinds.mod cp_files.mod input_constants.mod kahan_sum.mod physcon.mod periodic_table.mod mathconstants.mod ai_onecenter.mod qs_grid_atom.mod orbital_pointers.mod mathlib.mod splines.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 atom_upf.mod base_hooks.mod mathlib.mod atom_utils.mod input_constants.mod mathconstants.mod powell.mod kahan_sum.mod ai_onecenter.mod kinds.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="\"Thu Oct 7 17:09:44 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 atom_upf.mod base_hooks.mod mathlib.mod atom_utils.mod input_constants.mod mathconstants.mod powell.mod kahan_sum.mod ai_onecenter.mod kinds.mod 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 input_section_types.mod qs_dftb_types.mod base_hooks.mod cp_log_handling.mod cp_output_handling.mod kinds.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="\"Thu Oct 7 17:09:52 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_section_types.mod qs_dftb_types.mod base_hooks.mod cp_log_handling.mod cp_output_handling.mod kinds.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_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 basis_set_types.mod atomic_kind_types.mod semi_empirical_types.mod paw_proj_set_types.mod cp_control_types.mod xtb_types.mod cp_para_types.mod basis_set_container_types.mod qs_dftb_types.mod external_potential_types.mod qs_dispersion_types.mod input_section_types.mod atom_types.mod atom_upf.mod base_hooks.mod string_utilities.mod qs_harmonics_atom.mod semi_empirical_utils.mod kinds.mod xtb_parameters.mod input_constants.mod cp_log_handling.mod physcon.mod periodic_table.mod atom_sgp.mod mathconstants.mod qs_grid_atom.mod cp_output_handling.mod qs_dftb_utils.mod orbital_pointers.mod soft_basis_set.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="\"Thu Oct 7 17:09:54 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 basis_set_types.mod atomic_kind_types.mod semi_empirical_types.mod paw_proj_set_types.mod cp_control_types.mod xtb_types.mod cp_para_types.mod basis_set_container_types.mod qs_dftb_types.mod external_potential_types.mod qs_dispersion_types.mod input_section_types.mod atom_types.mod atom_upf.mod base_hooks.mod string_utilities.mod qs_harmonics_atom.mod semi_empirical_utils.mod kinds.mod xtb_parameters.mod input_constants.mod cp_log_handling.mod physcon.mod periodic_table.mod atom_sgp.mod mathconstants.mod qs_grid_atom.mod cp_output_handling.mod qs_dftb_utils.mod orbital_pointers.mod soft_basis_set.mod true /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 '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="\"Thu Oct 7 17:10:01 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 atomic_kind_types.mod cp_para_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/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="\"Thu Oct 7 17:10:01 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 atomic_kind_types.mod cp_para_types.mod base_hooks.mod message_passing.mod kinds.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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod multipole_types.mod qs_kind_types.mod cp_para_types.mod colvar_types.mod molecule_kind_types.mod virial_types.mod molecule_kind_list_types.mod atprop_types.mod atomic_kind_list_types.mod distribution_1d_types.mod cp_subsys_types.mod molecule_list_types.mod particle_list_types.mod qs_energy_types.mod qs_force_types.mod cp_result_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="\"Thu Oct 7 17:10:08 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod multipole_types.mod qs_kind_types.mod cp_para_types.mod colvar_types.mod molecule_kind_types.mod virial_types.mod molecule_kind_list_types.mod atprop_types.mod atomic_kind_list_types.mod distribution_1d_types.mod cp_subsys_types.mod molecule_list_types.mod particle_list_types.mod qs_energy_types.mod qs_force_types.mod cp_result_types.mod base_hooks.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 qs_subsys_types.mod cp_para_types.mod input_section_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/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="\"Thu Oct 7 17:10:09 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_subsys_types.mod cp_para_types.mod input_section_types.mod cp_subsys_types.mod base_hooks.mod kinds.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 particle_types.mod molecule_kind_types.mod virial_types.mod molecule_kind_list_types.mod particle_list_types.mod atomic_kind_types.mod molecule_types.mod atomic_kind_list_types.mod cell_types.mod input_section_types.mod distribution_1d_types.mod cp_subsys_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="\"Thu Oct 7 17:10:10 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod molecule_kind_types.mod virial_types.mod molecule_kind_list_types.mod particle_list_types.mod atomic_kind_types.mod molecule_types.mod atomic_kind_list_types.mod cell_types.mod input_section_types.mod distribution_1d_types.mod cp_subsys_types.mod molecule_list_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="\"Thu Oct 7 17:10:12 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:10:12 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 input_section_types.mod cp_para_types.mod parallel_rng_types.mod base_hooks.mod cp_para_env.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="\"Thu Oct 7 17:10:12 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_section_types.mod cp_para_types.mod parallel_rng_types.mod base_hooks.mod cp_para_env.mod kinds.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 input_section_types.mod cp_para_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod cp_output_handling.mod kinds.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="\"Thu Oct 7 17:10:13 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_section_types.mod cp_para_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod cp_output_handling.mod kinds.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_poisson_types.mod pw_pool_types.mod input_section_types.mod realspace_grid_types.mod base_hooks.mod cube_utils.mod gaussian_gridlevels.mod kinds.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="\"Thu Oct 7 17:10:14 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_poisson_types.mod pw_pool_types.mod input_section_types.mod realspace_grid_types.mod base_hooks.mod cube_utils.mod gaussian_gridlevels.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_kind_types.mod qs_cdft_types.mod pw_env_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod cp_array_utils.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/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="\"Thu Oct 7 17:10:14 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_kind_types.mod qs_cdft_types.mod pw_env_types.mod cp_fm_types.mod base_hooks.mod cp_log_handling.mod cp_array_utils.mod kinds.mod cp_blacs_env.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 machine.mod cp_log_handling.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/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="\"Thu Oct 7 17:10:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 machine.mod cp_log_handling.mod cp_array_utils.mod cp_blacs_env.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_cfm_types.mod distribution_2d_types.mod cp_para_types.mod cp_fm_types.mod base_hooks.mod mathlib.mod cp_fm_basic_linalg.mod kinds.mod cp_blacs_env.mod cp_fm_struct.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="\"Thu Oct 7 17:10:18 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_cfm_types.mod distribution_2d_types.mod cp_para_types.mod cp_fm_types.mod base_hooks.mod mathlib.mod cp_fm_basic_linalg.mod kinds.mod cp_blacs_env.mod cp_fm_struct.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 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/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="\"Thu Oct 7 17:10:20 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 base_hooks.mod cp_dbcsr_operations.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 kpoint_transitional.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_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="\"Thu Oct 7 17:10:21 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 kpoint_transitional.mod kinds.mod cp_dbcsr_operations.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 particle_types.mod mixed_cdft_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod mixed_energy_types.mod cp_para_types.mod molecule_kind_types.mod molecule_kind_list_types.mod atomic_kind_list_types.mod qs_rho_types.mod distribution_1d_types.mod cp_subsys_types.mod molecule_list_types.mod particle_list_types.mod input_section_types.mod cp_result_types.mod base_hooks.mod kinds.mod cp_log_handling.mod cp_para_env.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="\"Thu Oct 7 17:10:21 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod mixed_cdft_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod mixed_energy_types.mod cp_para_types.mod molecule_kind_types.mod molecule_kind_list_types.mod atomic_kind_list_types.mod qs_rho_types.mod distribution_1d_types.mod cp_subsys_types.mod molecule_list_types.mod particle_list_types.mod input_section_types.mod cp_result_types.mod base_hooks.mod kinds.mod cp_log_handling.mod cp_para_env.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="\"Thu Oct 7 17:10:23 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 shell_potential_types.mod pair_potential_types.mod damping_dipole_types.mod 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/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="\"Thu Oct 7 17:10:23 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 shell_potential_types.mod pair_potential_types.mod damping_dipole_types.mod force_field_kind_types.mod base_hooks.mod kinds.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_section_types.mod realspace_grid_types.mod input_keyword_types.mod base_hooks.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_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="\"Thu Oct 7 17:10:23 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_section_types.mod realspace_grid_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod kinds.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 dirichlet_bc_types.mod cell_types.mod multipole_types.mod input_keyword_types.mod dielectric_types.mod ps_implicit_types.mod pw_poisson_types.mod input_val_types.mod input_section_types.mod base_hooks.mod string_utilities.mod kinds.mod input_cp2k_rsgrid.mod input_constants.mod pw_spline_utils.mod bibliography.mod cp_output_handling.mod cp_units.mod dct.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="\"Thu Oct 7 17:10:24 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 dirichlet_bc_types.mod cell_types.mod multipole_types.mod input_keyword_types.mod dielectric_types.mod ps_implicit_types.mod pw_poisson_types.mod input_val_types.mod input_section_types.mod base_hooks.mod string_utilities.mod kinds.mod input_cp2k_rsgrid.mod input_constants.mod pw_spline_utils.mod bibliography.mod cp_output_handling.mod cp_units.mod dct.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 pw_poisson_types.mod input_enumeration_types.mod cp_para_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod mathconstants.mod cp_log_handling.mod cp_units.mod cp_output_handling.mod pw_grid_info.mod kinds.mod input_cp2k_poisson.mod cp_para_env.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="\"Thu Oct 7 17:10:26 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_poisson_types.mod input_enumeration_types.mod cp_para_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod mathconstants.mod cp_log_handling.mod cp_units.mod cp_output_handling.mod pw_grid_info.mod kinds.mod input_cp2k_poisson.mod cp_para_env.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: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 pw_poisson_types.mod dirichlet_bc_types.mod cell_types.mod ps_wavelet_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/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="\"Thu Oct 7 17:10:27 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_poisson_types.mod dirichlet_bc_types.mod cell_types.mod ps_wavelet_types.mod input_section_types.mod base_hooks.mod kinds.mod 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 '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 input_section_types.mod realspace_grid_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="\"Thu Oct 7 17:10:29 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_section_types.mod realspace_grid_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_pool_types.mod cell_types.mod realspace_grid_types.mod cp_para_types.mod pw_grid_types.mod ewald_environment_types.mod pw_poisson_types.mod dg_types.mod input_section_types.mod base_hooks.mod ao_util.mod dgs.mod kinds.mod pw_poisson_read_input.mod cp_log_handling.mod message_passing.mod pw_grids.mod mathconstants.mod cp_output_handling.mod pw_poisson_methods.mod cp_realspace_grid_init.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="\"Thu Oct 7 17:10:29 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_pool_types.mod cell_types.mod realspace_grid_types.mod cp_para_types.mod pw_grid_types.mod ewald_environment_types.mod pw_poisson_types.mod dg_types.mod input_section_types.mod base_hooks.mod ao_util.mod dgs.mod kinds.mod pw_poisson_read_input.mod cp_log_handling.mod message_passing.mod pw_grids.mod mathconstants.mod cp_output_handling.mod pw_poisson_methods.mod cp_realspace_grid_init.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="\"Thu Oct 7 17:10:30 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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="\"Thu Oct 7 17:10:36 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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.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 minimax_exp_k53.mod cp_log_handling.mod minimax_exp_k15.mod kinds.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="\"Thu Oct 7 17:10:49 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 minimax_exp_k53.mod cp_log_handling.mod minimax_exp_k15.mod kinds.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 minimax_exp.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_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="\"Thu Oct 7 17:10:50 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 minimax_exp.mod mathconstants.mod kinds.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="\"Thu Oct 7 17:10:51 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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/eri_mme/eri_mme_unroll.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod ao_util.mod eri_mme_gaussian.mod kinds.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_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="\"Thu Oct 7 17:10:51 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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/eri_mme/eri_mme_unroll.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod ao_util.mod eri_mme_gaussian.mod kinds.mod orbital_pointers.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 eri_mme_lattice_summation.mod mathconstants.mod ao_util.mod message_passing.mod eri_mme_gaussian.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_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="\"Thu Oct 7 17:13:58 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 eri_mme_lattice_summation.mod mathconstants.mod ao_util.mod message_passing.mod eri_mme_gaussian.mod kinds.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 mathlib.mod eri_mme_gaussian.mod eri_mme_util.mod kinds.mod eri_mme_error_control.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="\"Thu Oct 7 17:13:59 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathlib.mod eri_mme_gaussian.mod eri_mme_util.mod kinds.mod eri_mme_error_control.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 eri_mme_lattice_summation.mod mathconstants.mod ao_util.mod eri_mme_gaussian.mod kinds.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_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="\"Thu Oct 7 17:13:59 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 eri_mme_lattice_summation.mod mathconstants.mod ao_util.mod eri_mme_gaussian.mod kinds.mod orbital_pointers.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 eri_mme_types.mod cp_para_types.mod base_hooks.mod mathconstants.mod message_passing.mod eri_mme_integrate.mod eri_mme_gaussian.mod kinds.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_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="\"Thu Oct 7 17:14:02 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 eri_mme_types.mod cp_para_types.mod base_hooks.mod mathconstants.mod message_passing.mod eri_mme_integrate.mod eri_mme_gaussian.mod kinds.mod orbital_pointers.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 qs_kind_types.mod eri_mme_types.mod input_val_types.mod basis_set_types.mod cell_types.mod cp_para_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod cp_log_handling.mod message_passing.mod cp_output_handling.mod kinds.mod orbital_pointers.mod eri_mme_test.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="\"Thu Oct 7 17:14:04 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod eri_mme_types.mod input_val_types.mod basis_set_types.mod cell_types.mod cp_para_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod cp_log_handling.mod message_passing.mod cp_output_handling.mod kinds.mod orbital_pointers.mod eri_mme_test.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 particle_types.mod qmmm_gaussian_types.mod pw_pool_types.mod force_field_types.mod pw_types.mod pw_grid_types.mod ewald_environment_types.mod ewald_pw_types.mod base_hooks.mod input_constants.mod pw_grids.mod cp_eri_mme_interface.mod kinds.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="\"Thu Oct 7 17:14:06 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod qmmm_gaussian_types.mod pw_pool_types.mod force_field_types.mod pw_types.mod pw_grid_types.mod ewald_environment_types.mod ewald_pw_types.mod base_hooks.mod input_constants.mod pw_grids.mod cp_eri_mme_interface.mod kinds.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="\"Thu Oct 7 17:14:07 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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="\"Thu Oct 7 17:14:07 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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 cell_types.mod exclusion_types.mod base_hooks.mod memory_utilities.mod kinds.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="\"Thu Oct 7 17:14:07 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cell_types.mod exclusion_types.mod base_hooks.mod memory_utilities.mod kinds.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 cell_types.mod pair_potential_types.mod fist_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/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="\"Thu Oct 7 17:14:08 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cell_types.mod pair_potential_types.mod fist_neighbor_list_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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qmmm_types_low.mod multipole_types.mod exclusion_types.mod cp_para_types.mod fist_energy_types.mod molecule_kind_types.mod molecule_kind_list_types.mod atomic_kind_list_types.mod fist_efield_types.mod distribution_1d_types.mod ewald_environment_types.mod ewald_pw_types.mod cp_subsys_types.mod molecule_list_types.mod fist_nonbond_env_types.mod particle_list_types.mod input_section_types.mod cp_result_types.mod base_hooks.mod cp_para_env.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="\"Thu Oct 7 17:14:09 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qmmm_types_low.mod multipole_types.mod exclusion_types.mod cp_para_types.mod fist_energy_types.mod molecule_kind_types.mod molecule_kind_list_types.mod atomic_kind_list_types.mod fist_efield_types.mod distribution_1d_types.mod ewald_environment_types.mod ewald_pw_types.mod cp_subsys_types.mod molecule_list_types.mod fist_nonbond_env_types.mod particle_list_types.mod input_section_types.mod cp_result_types.mod base_hooks.mod cp_para_env.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 base_hooks.mod kinds.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="\"Thu Oct 7 17:14:10 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 base_hooks.mod kinds.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 particle_types.mod pw_types.mod cell_types.mod input_section_types.mod cp_para_types.mod base_hooks.mod mathlib.mod input_constants.mod cp_log_handling.mod mathconstants.mod message_passing.mod pw_spline_utils.mod kahan_sum.mod kinds.mod spherical_harmonics.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="\"Thu Oct 7 17:14:11 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod pw_types.mod cell_types.mod input_section_types.mod cp_para_types.mod base_hooks.mod mathlib.mod input_constants.mod cp_log_handling.mod mathconstants.mod message_passing.mod pw_spline_utils.mod kahan_sum.mod kinds.mod spherical_harmonics.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 pw_pool_types.mod pw_types.mod cell_types.mod input_section_types.mod cp_para_types.mod pw_grid_types.mod base_hooks.mod pw_methods.mod cp_log_handling.mod message_passing.mod pw_grids.mod pw_spline_utils.mod cp_output_handling.mod kinds.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="\"Thu Oct 7 17:14:14 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_pool_types.mod pw_types.mod cell_types.mod input_section_types.mod cp_para_types.mod pw_grid_types.mod base_hooks.mod pw_methods.mod cp_log_handling.mod message_passing.mod pw_grids.mod pw_spline_utils.mod cp_output_handling.mod kinds.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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_units.mod cp_output_handling.mod bibliography.mod kinds.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="\"Thu Oct 7 17:14:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_units.mod cp_output_handling.mod bibliography.mod kinds.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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod bibliography.mod kinds.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="\"Thu Oct 7 17:14:19 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod bibliography.mod kinds.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 input_val_types.mod input_section_types.mod input_keyword_types.mod force_field_kind_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_units.mod input_cp2k_poisson.mod cp_output_handling.mod input_cp2k_field.mod bibliography.mod kinds.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="\"Thu Oct 7 17:14:19 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_val_types.mod input_section_types.mod input_keyword_types.mod force_field_kind_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_units.mod input_cp2k_poisson.mod cp_output_handling.mod input_cp2k_field.mod bibliography.mod kinds.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_val_types.mod cell_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_units.mod input_cp2k_colvar.mod cp_output_handling.mod bibliography.mod kinds.mod input_cp2k_mm.mod physcon.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="\"Thu Oct 7 17:14:22 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_val_types.mod cell_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_units.mod input_cp2k_colvar.mod cp_output_handling.mod bibliography.mod kinds.mod input_cp2k_mm.mod physcon.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 input_enumeration_types.mod cell_types.mod cp_para_types.mod input_section_types.mod input_keyword_types.mod cp_parser_types.mod base_hooks.mod mathlib.mod input_constants.mod cp_log_handling.mod mathconstants.mod cp_units.mod cp_output_handling.mod kinds.mod input_cp2k_subsys.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="\"Thu Oct 7 17:14:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_enumeration_types.mod cell_types.mod cp_para_types.mod input_section_types.mod input_keyword_types.mod cp_parser_types.mod base_hooks.mod mathlib.mod input_constants.mod cp_log_handling.mod mathconstants.mod cp_units.mod cp_output_handling.mod kinds.mod input_cp2k_subsys.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 pw_poisson_types.mod particle_types.mod pw_pool_types.mod pw_types.mod cell_types.mod cp_para_types.mod input_section_types.mod pw_grid_types.mod base_hooks.mod mathconstants.mod cp_log_handling.mod cp_ddapc_methods.mod pw_grids.mod cp_output_handling.mod ewald_spline_util.mod cell_methods.mod kinds.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="\"Thu Oct 7 17:14:26 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_poisson_types.mod particle_types.mod pw_pool_types.mod pw_types.mod cell_types.mod cp_para_types.mod input_section_types.mod pw_grid_types.mod base_hooks.mod mathconstants.mod cp_log_handling.mod cp_ddapc_methods.mod pw_grids.mod cp_output_handling.mod ewald_spline_util.mod cell_methods.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="\"Thu Oct 7 17:14:27 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 qs_kind_types.mod particle_types.mod basis_set_types.mod qs_neighbor_list_types.mod cell_types.mod external_potential_types.mod base_hooks.mod ai_moments.mod ai_overlap.mod kinds.mod orbital_pointers.mod util.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="\"Thu Oct 7 17:14:27 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod basis_set_types.mod qs_neighbor_list_types.mod cell_types.mod external_potential_types.mod base_hooks.mod ai_moments.mod ai_overlap.mod kinds.mod orbital_pointers.mod util.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="\"Thu Oct 7 17:14:32 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 base_hooks.mod kinds.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="\"Thu Oct 7 17:14:32 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 base_hooks.mod kinds.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="\"Thu Oct 7 17:14:32 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 pw_types.mod qs_rho_atom_types.mod base_hooks.mod mathconstants.mod cp_units.mod memory_utilities.mod qs_grid_atom.mod kinds.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="\"Thu Oct 7 17:14:33 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_types.mod qs_rho_atom_types.mod base_hooks.mod mathconstants.mod cp_units.mod memory_utilities.mod qs_grid_atom.mod kinds.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 mathconstants.mod qs_harmonics_atom.mod memory_utilities.mod qs_grid_atom.mod kinds.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="\"Thu Oct 7 17:14:34 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathconstants.mod qs_harmonics_atom.mod memory_utilities.mod qs_grid_atom.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 grid_api.mod base_hooks.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="\"Thu Oct 7 17:14:34 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 grid_api.mod base_hooks.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_types.mod cp_fm_pool_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="\"Thu Oct 7 17:14:35 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_types.mod cp_fm_pool_types.mod base_hooks.mod kinds.mod cp_dbcsr_operations.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 qs_kind_types.mod qs_oce_types.mod cp_control_types.mod qs_local_rho_types.mod task_list_types.mod cp_para_types.mod input_section_types.mod cp_fm_types.mod qs_mo_types.mod base_hooks.mod input_constants.mod kinds.mod bibliography.mod cp_fm_struct.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="\"Thu Oct 7 17:14:35 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod qs_oce_types.mod cp_control_types.mod qs_local_rho_types.mod task_list_types.mod cp_para_types.mod input_section_types.mod cp_fm_types.mod qs_mo_types.mod base_hooks.mod input_constants.mod kinds.mod bibliography.mod cp_fm_struct.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 base_hooks.mod input_constants.mod kinds.mod cp_blacs_env.mod cp_para_env.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="\"Thu Oct 7 17:14:37 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 base_hooks.mod input_constants.mod kinds.mod cp_blacs_env.mod cp_para_env.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 preconditioner_types.mod cp_para_types.mod input_section_types.mod base_hooks.mod input_constants.mod cp_blacs_env.mod bibliography.mod cp_fm_struct.mod kinds.mod cp_dbcsr_operations.mod cp_para_env.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="\"Thu Oct 7 17:14:37 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 preconditioner_types.mod cp_para_types.mod input_section_types.mod base_hooks.mod input_constants.mod cp_blacs_env.mod bibliography.mod cp_fm_struct.mod kinds.mod cp_dbcsr_operations.mod cp_para_env.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_section_types.mod input_keyword_types.mod qs_rho_atom_types.mod base_hooks.mod string_utilities.mod input_constants.mod ao_util.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_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="\"Thu Oct 7 17:14:39 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_section_types.mod input_keyword_types.mod qs_rho_atom_types.mod base_hooks.mod string_utilities.mod input_constants.mod ao_util.mod kinds.mod cp_dbcsr_operations.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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod bibliography.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="\"Thu Oct 7 17:14:40 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod bibliography.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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod bibliography.mod kinds.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="\"Thu Oct 7 17:14:41 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod bibliography.mod kinds.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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_output_handling.mod input_cp2k_subsys.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="\"Thu Oct 7 17:14:41 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_output_handling.mod input_cp2k_subsys.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 pw_types.mod input_section_types.mod base_hooks.mod pw_methods.mod pw_spline_utils.mod kinds.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="\"Thu Oct 7 17:14:41 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_types.mod input_section_types.mod base_hooks.mod pw_methods.mod pw_spline_utils.mod kinds.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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod bibliography.mod kinds.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="\"Thu Oct 7 17:14:42 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod bibliography.mod kinds.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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod bibliography.mod kinds.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="\"Thu Oct 7 17:14:42 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod bibliography.mod kinds.mod input_cp2k_mm.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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_units.mod cp_output_handling.mod bibliography.mod kinds.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="\"Thu Oct 7 17:14:43 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_units.mod cp_output_handling.mod bibliography.mod kinds.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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_cp2k_motion_print.mod input_constants.mod cp_output_handling.mod bibliography.mod kinds.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="\"Thu Oct 7 17:14:44 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_cp2k_motion_print.mod input_constants.mod cp_output_handling.mod bibliography.mod kinds.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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod input_cp2k_loc.mod cp_output_handling.mod bibliography.mod kinds.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="\"Thu Oct 7 17:14:45 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod input_cp2k_loc.mod cp_output_handling.mod bibliography.mod kinds.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="\"Thu Oct 7 17:14:46 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod input_cp2k_hfx.mod cp_units.mod cp_output_handling.mod cp_eri_mme_interface.mod bibliography.mod kinds.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="\"Thu Oct 7 17:14:46 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod input_cp2k_hfx.mod cp_units.mod cp_output_handling.mod cp_eri_mme_interface.mod bibliography.mod kinds.mod 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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod input_cp2k_hfx.mod xc_input_constants.mod cp_output_handling.mod bibliography.mod kinds.mod input_cp2k_mp2.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="\"Thu Oct 7 17:14:48 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod input_cp2k_hfx.mod xc_input_constants.mod cp_output_handling.mod bibliography.mod kinds.mod input_cp2k_mp2.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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod bibliography.mod input_cp2k_xc.mod kinds.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="\"Thu Oct 7 17:14:51 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod bibliography.mod input_cp2k_xc.mod kinds.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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod cp_units.mod bibliography.mod kinds.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="\"Thu Oct 7 17:14:52 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod cp_units.mod bibliography.mod kinds.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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_output_handling.mod bibliography.mod kinds.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="\"Thu Oct 7 17:14:53 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_output_handling.mod bibliography.mod kinds.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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod cp_log_handling.mod cp_output_handling.mod kinds.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="\"Thu Oct 7 17:14:54 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod cp_log_handling.mod cp_output_handling.mod kinds.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 base_hooks.mod linesearch.mod kinds.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="\"Thu Oct 7 17:14:54 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 base_hooks.mod linesearch.mod kinds.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 input_val_types.mod pao_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod cp_log_handling.mod linesearch.mod cp_output_handling.mod bibliography.mod kinds.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="\"Thu Oct 7 17:14:55 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_val_types.mod pao_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod cp_log_handling.mod linesearch.mod cp_output_handling.mod bibliography.mod kinds.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_val_types.mod qs_density_mixing_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_units.mod cp_output_handling.mod pao_input.mod bibliography.mod kinds.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="\"Thu Oct 7 17:14:56 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_val_types.mod qs_density_mixing_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_units.mod cp_output_handling.mod pao_input.mod bibliography.mod kinds.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_section_types.mod input_keyword_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="\"Thu Oct 7 17:14:57 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_section_types.mod input_keyword_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 basis_set_types.mod input_keyword_types.mod input_val_types.mod qs_density_mixing_types.mod input_section_types.mod qs_mom_types.mod base_hooks.mod input_cp2k_external.mod string_utilities.mod input_cp2k_motion_print.mod cp_spline_utils.mod input_cp2k_kpoints.mod kinds.mod input_cp2k_poisson.mod input_cp2k_tb.mod input_cp2k_rsgrid.mod input_cp2k_transport.mod input_constants.mod input_cp2k_ec.mod pw_grids.mod pw_spline_utils.mod input_cp2k_field.mod bibliography.mod qs_fb_input.mod cp_output_handling.mod input_cp2k_almo.mod input_cp2k_ls.mod input_cp2k_xc.mod input_cp2k_distribution.mod cp_units.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_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="\"Thu Oct 7 17:14:58 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 basis_set_types.mod input_keyword_types.mod input_val_types.mod qs_density_mixing_types.mod input_section_types.mod qs_mom_types.mod base_hooks.mod input_cp2k_external.mod string_utilities.mod input_cp2k_motion_print.mod cp_spline_utils.mod input_cp2k_kpoints.mod kinds.mod input_cp2k_poisson.mod input_cp2k_tb.mod input_cp2k_rsgrid.mod input_cp2k_transport.mod input_constants.mod input_cp2k_ec.mod pw_grids.mod pw_spline_utils.mod input_cp2k_field.mod bibliography.mod qs_fb_input.mod cp_output_handling.mod input_cp2k_almo.mod input_cp2k_ls.mod input_cp2k_xc.mod input_cp2k_distribution.mod cp_units.mod input_cp2k_mm.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 input_enumeration_types.mod qs_cdft_opt_types.mod qs_ot_types.mod input_section_types.mod outer_scf_control_types.mod input_keyword_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod cp_units.mod input_cp2k_dft.mod cp_output_handling.mod kinds.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="\"Thu Oct 7 17:15:14 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_enumeration_types.mod qs_cdft_opt_types.mod qs_ot_types.mod input_section_types.mod outer_scf_control_types.mod input_keyword_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod cp_units.mod input_cp2k_dft.mod cp_output_handling.mod kinds.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 qs_kind_types.mod particle_types.mod atomic_kind_types.mod cell_types.mod cp_para_types.mod input_section_types.mod base_hooks.mod string_utilities.mod cp_log_handling.mod message_passing.mod memory_utilities.mod cp_output_handling.mod kinds.mod util.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="\"Thu Oct 7 17:15:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod atomic_kind_types.mod cell_types.mod cp_para_types.mod input_section_types.mod base_hooks.mod string_utilities.mod cp_log_handling.mod message_passing.mod memory_utilities.mod cp_output_handling.mod kinds.mod util.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="\"Thu Oct 7 17:15:17 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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_atomic_halo_types.mod qs_fb_trial_fns_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="\"Thu Oct 7 17:15:17 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_atomic_halo_types.mod qs_fb_trial_fns_types.mod base_hooks.mod kinds.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 base_hooks.mod kinds.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="\"Thu Oct 7 17:15:17 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 base_hooks.mod kinds.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 cp_fm_types.mod input_section_types.mod base_hooks.mod cp_fm_struct.mod kinds.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="\"Thu Oct 7 17:15:18 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_fm_types.mod input_section_types.mod base_hooks.mod cp_fm_struct.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 preconditioner_types.mod qs_density_mixing_types.mod qs_ot_types.mod qs_fb_env_types.mod input_section_types.mod outer_scf_control_types.mod qs_diis_types.mod qs_block_davidson_types.mod cp_fm_types.mod base_hooks.mod cp_fm_vect.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_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="\"Thu Oct 7 17:15:18 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 preconditioner_types.mod qs_density_mixing_types.mod qs_ot_types.mod qs_fb_env_types.mod input_section_types.mod outer_scf_control_types.mod qs_diis_types.mod qs_block_davidson_types.mod cp_fm_types.mod base_hooks.mod cp_fm_vect.mod kinds.mod cp_dbcsr_operations.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 particle_types.mod cell_types.mod cp_para_types.mod distribution_1d_types.mod cp_fm_types.mod base_hooks.mod cp_array_utils.mod kinds.mod cp_para_env.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="\"Thu Oct 7 17:15:20 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod cell_types.mod cp_para_types.mod distribution_1d_types.mod cp_fm_types.mod base_hooks.mod cp_array_utils.mod kinds.mod cp_para_env.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 scf_control_types.mod basis_set_types.mod qs_scf_types.mod cp_fm_pool_types.mod qs_loc_types.mod cp_fm_types.mod base_hooks.mod cp_array_utils.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/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="\"Thu Oct 7 17:15:20 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 scf_control_types.mod basis_set_types.mod qs_scf_types.mod cp_fm_pool_types.mod qs_loc_types.mod cp_fm_types.mod base_hooks.mod cp_array_utils.mod kinds.mod cp_dbcsr_operations.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="\"Thu Oct 7 17:15:21 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:15:21 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_constants.mod cp_blacs_env.mod kinds.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="\"Thu Oct 7 17:15:22 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_constants.mod cp_blacs_env.mod kinds.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="\"Thu Oct 7 17:15:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 distribution_2d_types.mod particle_types.mod basis_set_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod cp_para_types.mod base_hooks.mod message_passing.mod cp_array_utils.mod cp_blacs_env.mod cp_para_env.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="\"Thu Oct 7 17:15:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 distribution_2d_types.mod particle_types.mod basis_set_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod cp_para_types.mod base_hooks.mod message_passing.mod cp_array_utils.mod cp_blacs_env.mod cp_para_env.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 qs_kind_types.mod basis_set_types.mod cp_control_types.mod atomic_kind_types.mod input_section_types.mod external_potential_types.mod paw_proj_set_types.mod base_hooks.mod string_utilities.mod cp_log_handling.mod ao_util.mod cp_units.mod cp_output_handling.mod kinds.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="\"Thu Oct 7 17:15:26 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod basis_set_types.mod cp_control_types.mod atomic_kind_types.mod input_section_types.mod external_potential_types.mod paw_proj_set_types.mod base_hooks.mod string_utilities.mod cp_log_handling.mod ao_util.mod cp_units.mod cp_output_handling.mod kinds.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="\"Thu Oct 7 17:15:29 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathconstants.mod input_constants.mod libint_wrapper.mod t_c_g0.mod gamma.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_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="\"Thu Oct 7 17:15:29 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathconstants.mod input_constants.mod libint_wrapper.mod t_c_g0.mod gamma.mod kinds.mod orbital_pointers.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="\"Thu Oct 7 17:15:31 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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="\"Thu Oct 7 17:15:31 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:15:32 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod shell_potential_types.mod external_potential_types.mod input_section_types.mod base_hooks.mod string_utilities.mod kinds.mod util.mod input_constants.mod cp_log_handling.mod physcon.mod mathconstants.mod memory_utilities.mod cp_output_handling.mod qmmm_ff_fist.mod mathlib.mod cp_units.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="\"Thu Oct 7 17:15:32 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod shell_potential_types.mod external_potential_types.mod input_section_types.mod base_hooks.mod string_utilities.mod kinds.mod util.mod input_constants.mod cp_log_handling.mod physcon.mod mathconstants.mod memory_utilities.mod cp_output_handling.mod qmmm_ff_fist.mod mathlib.mod cp_units.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 qs_kind_types.mod basis_set_types.mod base_hooks.mod aux_basis_set.mod powell.mod mathconstants.mod bibliography.mod kinds.mod orbital_pointers.mod periodic_table.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="\"Thu Oct 7 17:15:35 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod basis_set_types.mod base_hooks.mod aux_basis_set.mod powell.mod mathconstants.mod bibliography.mod kinds.mod orbital_pointers.mod periodic_table.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_loc_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod basis_set_container_types.mod input_section_types.mod qs_tensors_types.mod base_hooks.mod qs_interactions.mod string_utilities.mod libint_2c_3c.mod kinds.mod cp_files.mod input_constants.mod cp_log_handling.mod message_passing.mod hfx_helpers.mod t_c_g0.mod bibliography.mod input_cp2k_hfx.mod cp_output_handling.mod orbital_pointers.mod mathlib.mod machine.mod cp_units.mod qs_integral_utils.mod libint_wrapper.mod particle_methods.mod auto_basis.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="\"Thu Oct 7 17:15:39 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_loc_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod basis_set_container_types.mod input_section_types.mod qs_tensors_types.mod base_hooks.mod qs_interactions.mod string_utilities.mod libint_2c_3c.mod kinds.mod cp_files.mod input_constants.mod cp_log_handling.mod message_passing.mod hfx_helpers.mod t_c_g0.mod bibliography.mod input_cp2k_hfx.mod cp_output_handling.mod orbital_pointers.mod mathlib.mod machine.mod cp_units.mod qs_integral_utils.mod libint_wrapper.mod particle_methods.mod auto_basis.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="\"Thu Oct 7 17:15:56 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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="\"Thu Oct 7 17:16:31 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 memory_utilities.mod kinds.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="\"Thu Oct 7 17:16:32 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 memory_utilities.mod kinds.mod hfx_compression_methods.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="\"Thu Oct 7 17:16:33 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 atomic_kind_types.mod qs_o3c_types.mod base_hooks.mod mathlib.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/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="\"Thu Oct 7 17:16:33 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 atomic_kind_types.mod qs_o3c_types.mod base_hooks.mod mathlib.mod kinds.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="\"Thu Oct 7 17:16:37 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 lri_environment_types.mod integration_grid_types.mod qs_neighbor_list_types.mod qs_dispersion_types.mod molecule_types.mod task_list_types.mod input_section_types.mod base_hooks.mod qs_grid_atom.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/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="\"Thu Oct 7 17:16:38 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 lri_environment_types.mod integration_grid_types.mod qs_neighbor_list_types.mod qs_dispersion_types.mod molecule_types.mod task_list_types.mod input_section_types.mod base_hooks.mod qs_grid_atom.mod kinds.mod cp_dbcsr_operations.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 input_constants.mod kinds.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="\"Thu Oct 7 17:16:38 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_constants.mod kinds.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 input_constants.mod libint_2c_3c.mod kinds.mod cp_eri_mme_interface.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="\"Thu Oct 7 17:16:39 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_constants.mod libint_2c_3c.mod kinds.mod cp_eri_mme_interface.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_fm_pool_types.mod cp_para_types.mod qs_mo_types.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.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="\"Thu Oct 7 17:16:40 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_fm_pool_types.mod cp_para_types.mod qs_mo_types.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.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_control_types.mod cp_fm_pool_types.mod cp_fm_types.mod qs_mo_types.mod base_hooks.mod cp_log_handling.mod cp_fm_vect.mod qs_matrix_pools.mod kinds.mod bibliography.mod cp_fm_struct.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="\"Thu Oct 7 17:16:42 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_control_types.mod cp_fm_pool_types.mod cp_fm_types.mod qs_mo_types.mod base_hooks.mod cp_log_handling.mod cp_fm_vect.mod qs_matrix_pools.mod kinds.mod bibliography.mod cp_fm_struct.mod cp_dbcsr_operations.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 base_hooks.mod kinds.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="\"Thu Oct 7 17:16:43 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 base_hooks.mod kinds.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 qs_kind_types.mod basis_set_types.mod atomic_kind_types.mod qs_rho_types.mod realspace_grid_types.mod qs_loc_types.mod cp_fm_types.mod qs_rho_atom_types.mod base_hooks.mod qs_harmonics_atom.mod cp_array_utils.mod qs_grid_atom.mod kinds.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="\"Thu Oct 7 17:16:44 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod basis_set_types.mod atomic_kind_types.mod qs_rho_types.mod realspace_grid_types.mod qs_loc_types.mod cp_fm_types.mod qs_rho_atom_types.mod base_hooks.mod qs_harmonics_atom.mod cp_array_utils.mod qs_grid_atom.mod kinds.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 base_hooks.mod kinds.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="\"Thu Oct 7 17:16:50 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 base_hooks.mod kinds.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 base_hooks.mod cp_dbcsr_operations.mod kinds.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="\"Thu Oct 7 17:16:50 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 base_hooks.mod cp_dbcsr_operations.mod kinds.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="\"Thu Oct 7 17:16:51 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_methods.mod xc_input_constants.mod pw_spline_utils.mod cp_array_utils.mod kinds.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="\"Thu Oct 7 17:16:51 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_methods.mod xc_input_constants.mod pw_spline_utils.mod cp_array_utils.mod kinds.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="\"Thu Oct 7 17:16:54 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 xc_derivative_desc.mod kinds.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="\"Thu Oct 7 17:16:54 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 xc_derivative_desc.mod kinds.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/common/cp_linked_list.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 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="\"Thu Oct 7 17:16:54 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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/common/cp_linked_list.fypp /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 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_pool_types.mod pw_grid_types.mod xc_derivative_types.mod base_hooks.mod xc_derivative_desc.mod message_passing.mod pw_grids.mod kinds.mod cp_linked_list_xc_deriv.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="\"Thu Oct 7 17:16:55 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_pool_types.mod pw_grid_types.mod xc_derivative_types.mod base_hooks.mod xc_derivative_desc.mod message_passing.mod pw_grids.mod kinds.mod cp_linked_list_xc_deriv.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_rho_set_types.mod xc_derivative_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="\"Thu Oct 7 17:16:55 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod pw_types.mod base_hooks.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 preconditioner_types.mod hartree_local_types.mod qs_local_rho_types.mod qs_rho_types.mod qs_kpp1_env_types.mod cp_fm_types.mod base_hooks.mod cp_fm_vect.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_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="\"Thu Oct 7 17:16:55 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 preconditioner_types.mod hartree_local_types.mod qs_local_rho_types.mod qs_rho_types.mod qs_kpp1_env_types.mod cp_fm_types.mod base_hooks.mod cp_fm_vect.mod kinds.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_period_efield_types.mod qs_neighbor_list_types.mod qs_dispersion_types.mod cp_fm_types.mod pw_types.mod qs_p_env_types.mod task_list_types.mod input_section_types.mod qs_force_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="\"Thu Oct 7 17:16:56 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_period_efield_types.mod qs_neighbor_list_types.mod qs_dispersion_types.mod cp_fm_types.mod pw_types.mod qs_p_env_types.mod task_list_types.mod input_section_types.mod qs_force_types.mod base_hooks.mod kinds.mod cp_dbcsr_operations.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 qs_neighbor_list_types.mod cp_para_types.mod input_section_types.mod cp_fm_types.mod qs_mo_types.mod base_hooks.mod string_utilities.mod mathconstants.mod cp_log_handling.mod qs_matrix_pools.mod input_cp2k_kpoints.mod cp_output_handling.mod kinds.mod cp_blacs_env.mod physcon.mod cp_para_env.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="\"Thu Oct 7 17:16:57 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_neighbor_list_types.mod cp_para_types.mod input_section_types.mod cp_fm_types.mod qs_mo_types.mod base_hooks.mod string_utilities.mod mathconstants.mod cp_log_handling.mod qs_matrix_pools.mod input_cp2k_kpoints.mod cp_output_handling.mod kinds.mod cp_blacs_env.mod physcon.mod cp_para_env.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 distribution_2d_types.mod particle_types.mod atomic_kind_types.mod pw_types.mod molecule_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod qs_kind_types.mod admm_dm_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod molecule_kind_types.mod virial_types.mod atprop_types.mod kpoint_types.mod qs_rho_types.mod distribution_1d_types.mod cp_subsys_types.mod qs_energy_types.mod task_list_types.mod qs_force_types.mod cp_result_types.mod base_hooks.mod kpoint_transitional.mod cp_blacs_env.mod cp_para_env.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="\"Thu Oct 7 17:16:58 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 distribution_2d_types.mod particle_types.mod atomic_kind_types.mod pw_types.mod molecule_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod qs_kind_types.mod admm_dm_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod molecule_kind_types.mod virial_types.mod atprop_types.mod kpoint_types.mod qs_rho_types.mod distribution_1d_types.mod cp_subsys_types.mod qs_energy_types.mod task_list_types.mod qs_force_types.mod cp_result_types.mod base_hooks.mod kpoint_transitional.mod cp_blacs_env.mod cp_para_env.mod cp_dbcsr_operations.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 pw_types.mod cp_fm_types.mod qs_rho_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="\"Thu Oct 7 17:17:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_types.mod cp_fm_types.mod qs_rho_types.mod base_hooks.mod kinds.mod cp_dbcsr_operations.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="\"Thu Oct 7 17:17:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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_types.mod pw_env_types.mod base_hooks.mod cube_utils.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_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="\"Thu Oct 7 17:17:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_types.mod pw_env_types.mod base_hooks.mod cube_utils.mod kinds.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="\"Thu Oct 7 17:17:01 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:17:01 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_log_handling.mod message_passing.mod bibliography.mod kinds.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="\"Thu Oct 7 17:17:01 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_log_handling.mod message_passing.mod bibliography.mod kinds.mod pexsi_interface.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 qs_density_mixing_types.mod pao_types.mod input_section_types.mod cp_para_types.mod pexsi_types.mod base_hooks.mod input_constants.mod kinds.mod cp_para_env.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="\"Thu Oct 7 17:17:02 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_density_mixing_types.mod pao_types.mod input_section_types.mod cp_para_types.mod pexsi_types.mod base_hooks.mod input_constants.mod kinds.mod cp_para_env.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 cp_fm_types.mod qs_mo_types.mod base_hooks.mod message_passing.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_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="\"Thu Oct 7 17:17:03 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_fm_types.mod qs_mo_types.mod base_hooks.mod message_passing.mod kinds.mod cp_dbcsr_operations.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 distribution_2d_types.mod mscfg_types.mod cp_ddapc_types.mod particle_types.mod rel_control_types.mod atomic_kind_types.mod pw_types.mod molecule_types.mod semi_empirical_mpole_types.mod cell_types.mod qs_subsys_types.mod admm_types.mod pw_env_types.mod qmmm_types_low.mod semi_empirical_types.mod xas_env_types.mod qs_kind_types.mod hartree_local_types.mod almo_scf_types.mod qs_gcp_types.mod semi_empirical_store_int_types.mod kg_environment_types.mod admm_dm_types.mod cp_control_types.mod mp2_types.mod qs_local_rho_types.mod qs_neighbor_list_types.mod rt_propagation_types.mod qs_rho0_types.mod cp_para_types.mod et_coupling_types.mod qs_linres_types.mod transport_env_types.mod cp_fm_types.mod ec_env_types.mod qs_ks_types.mod qs_dftb_types.mod qs_rho_atom_types.mod global_types.mod molecule_kind_types.mod qs_oce_types.mod qs_wf_history_types.mod virial_types.mod atprop_types.mod wannier_states_types.mod qs_ks_qmmm_types.mod kpoint_types.mod qs_rho_types.mod distribution_1d_types.mod ewald_environment_types.mod ewald_pw_types.mod cp_subsys_types.mod fist_nonbond_env_types.mod qs_charges_types.mod qs_scf_types.mod dm_ls_scf_types.mod scf_control_types.mod qs_period_efield_types.mod hfx_types.mod qs_dispersion_types.mod qs_energy_types.mod task_list_types.mod input_section_types.mod qs_force_types.mod lri_environment_types.mod cp_result_types.mod qs_active_space_types.mod qs_mo_types.mod base_hooks.mod cp_blacs_env.mod kinds.mod input_constants.mod qs_matrix_pools.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="\"Thu Oct 7 17:17:04 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 distribution_2d_types.mod mscfg_types.mod cp_ddapc_types.mod particle_types.mod rel_control_types.mod atomic_kind_types.mod pw_types.mod molecule_types.mod semi_empirical_mpole_types.mod cell_types.mod qs_subsys_types.mod admm_types.mod pw_env_types.mod qmmm_types_low.mod semi_empirical_types.mod xas_env_types.mod qs_kind_types.mod hartree_local_types.mod almo_scf_types.mod qs_gcp_types.mod semi_empirical_store_int_types.mod kg_environment_types.mod admm_dm_types.mod cp_control_types.mod mp2_types.mod qs_local_rho_types.mod qs_neighbor_list_types.mod rt_propagation_types.mod qs_rho0_types.mod cp_para_types.mod et_coupling_types.mod qs_linres_types.mod transport_env_types.mod cp_fm_types.mod ec_env_types.mod qs_ks_types.mod qs_dftb_types.mod qs_rho_atom_types.mod global_types.mod molecule_kind_types.mod qs_oce_types.mod qs_wf_history_types.mod virial_types.mod atprop_types.mod wannier_states_types.mod qs_ks_qmmm_types.mod kpoint_types.mod qs_rho_types.mod distribution_1d_types.mod ewald_environment_types.mod ewald_pw_types.mod cp_subsys_types.mod fist_nonbond_env_types.mod qs_charges_types.mod qs_scf_types.mod dm_ls_scf_types.mod scf_control_types.mod qs_period_efield_types.mod hfx_types.mod qs_dispersion_types.mod qs_energy_types.mod task_list_types.mod input_section_types.mod qs_force_types.mod lri_environment_types.mod cp_result_types.mod qs_active_space_types.mod qs_mo_types.mod base_hooks.mod cp_blacs_env.mod kinds.mod input_constants.mod qs_matrix_pools.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 fist_environment_types.mod qmmm_types_low.mod fist_energy_types.mod cp_subsys_types.mod qs_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/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="\"Thu Oct 7 17:17:07 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 fist_environment_types.mod qmmm_types_low.mod fist_energy_types.mod cp_subsys_types.mod qs_environment_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 cp_output_handling.mod kinds.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="\"Thu Oct 7 17:17:09 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_output_handling.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 cp_subsys_types.mod qmmm_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="\"Thu Oct 7 17:17:09 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_subsys_types.mod qmmm_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 particle_types.mod atomic_kind_types.mod pw_types.mod molecule_types.mod cell_types.mod cp_para_types.mod cp_fm_types.mod molecule_kind_types.mod molecule_kind_list_types.mod atomic_kind_list_types.mod distribution_1d_types.mod cp_subsys_types.mod molecule_list_types.mod particle_list_types.mod input_section_types.mod lri_environment_types.mod cp_result_types.mod base_hooks.mod kinds.mod cp_log_handling.mod cp_para_env.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="\"Thu Oct 7 17:17:10 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_types.mod molecule_types.mod cell_types.mod cp_para_types.mod cp_fm_types.mod molecule_kind_types.mod molecule_kind_list_types.mod atomic_kind_list_types.mod distribution_1d_types.mod cp_subsys_types.mod molecule_list_types.mod particle_list_types.mod input_section_types.mod lri_environment_types.mod cp_result_types.mod base_hooks.mod kinds.mod cp_log_handling.mod cp_para_env.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 particle_types.mod molecule_kind_types.mod virial_types.mod molecule_kind_list_types.mod particle_list_types.mod atomic_kind_types.mod molecule_types.mod atomic_kind_list_types.mod cell_types.mod input_section_types.mod distribution_1d_types.mod cp_subsys_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="\"Thu Oct 7 17:17:11 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod molecule_kind_types.mod virial_types.mod molecule_kind_list_types.mod particle_list_types.mod atomic_kind_types.mod molecule_types.mod atomic_kind_list_types.mod cell_types.mod input_section_types.mod distribution_1d_types.mod cp_subsys_types.mod molecule_list_types.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 pwdft_environment_types.mod cell_types.mod nnp_environment_types.mod mixed_energy_types.mod cp_para_types.mod fist_energy_types.mod metadynamics_types.mod mixed_environment_types.mod global_types.mod qmmm_types.mod fist_environment_types.mod fp_types.mod qs_environment_types.mod cp_subsys_types.mod qmmmx_types.mod embed_types.mod eip_environment_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_log_handling.mod cp_para_env.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="\"Thu Oct 7 17:17:12 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pwdft_environment_types.mod cell_types.mod nnp_environment_types.mod mixed_energy_types.mod cp_para_types.mod fist_energy_types.mod metadynamics_types.mod mixed_environment_types.mod global_types.mod qmmm_types.mod fist_environment_types.mod fp_types.mod qs_environment_types.mod cp_subsys_types.mod qmmmx_types.mod embed_types.mod eip_environment_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_log_handling.mod cp_para_env.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 qs_kind_types.mod qs_ks_types.mod basis_set_types.mod cp_control_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod ao_util.mod qs_integral_utils.mod bibliography.mod kinds.mod cp_dbcsr_operations.mod orbital_pointers.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="\"Thu Oct 7 17:17:15 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod qs_ks_types.mod basis_set_types.mod cp_control_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod ao_util.mod qs_integral_utils.mod bibliography.mod kinds.mod cp_dbcsr_operations.mod orbital_pointers.mod 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_section_types.mod input_keyword_types.mod cp_fm_elpa.mod grid_api.mod base_hooks.mod string_utilities.mod input_constants.mod machine.mod cp_output_handling.mod cp_blacs_env.mod timings.mod bibliography.mod kinds.mod cp_dbcsr_cp2k_link.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="\"Thu Oct 7 17:17:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_section_types.mod input_keyword_types.mod cp_fm_elpa.mod grid_api.mod base_hooks.mod string_utilities.mod input_constants.mod machine.mod cp_output_handling.mod cp_blacs_env.mod timings.mod bibliography.mod kinds.mod cp_dbcsr_cp2k_link.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 input_enumeration_types.mod cell_types.mod cp_para_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod mathlib.mod input_constants.mod cp_log_handling.mod mathconstants.mod cp_units.mod input_cp2k_global.mod kinds.mod cp_files.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="\"Thu Oct 7 17:17:18 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_enumeration_types.mod cell_types.mod cp_para_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod mathlib.mod input_constants.mod cp_log_handling.mod mathconstants.mod cp_units.mod input_cp2k_global.mod kinds.mod cp_files.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 particle_list_types.mod force_env_types.mod cell_types.mod input_section_types.mod cp_subsys_types.mod base_hooks.mod cell_opt_utils.mod cp_log_handling.mod input_constants.mod cp_units.mod cp_output_handling.mod kinds.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="\"Thu Oct 7 17:17:19 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_list_types.mod force_env_types.mod cell_types.mod input_section_types.mod cp_subsys_types.mod base_hooks.mod cell_opt_utils.mod cp_log_handling.mod input_constants.mod cp_units.mod cp_output_handling.mod 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 global_types.mod molecule_kind_list_types.mod molecule_kind_types.mod cell_types.mod input_section_types.mod cp_subsys_types.mod base_hooks.mod input_constants.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/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="\"Thu Oct 7 17:17:21 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 global_types.mod molecule_kind_list_types.mod molecule_kind_types.mod cell_types.mod input_section_types.mod cp_subsys_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod kinds.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 global_types.mod gopt_param_types.mod force_env_types.mod particle_list_types.mod input_section_types.mod cell_opt_types.mod cp_subsys_types.mod dimer_types.mod base_hooks.mod input_constants.mod kinds.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="\"Thu Oct 7 17:17:21 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 global_types.mod gopt_param_types.mod force_env_types.mod particle_list_types.mod input_section_types.mod cell_opt_types.mod cp_subsys_types.mod dimer_types.mod base_hooks.mod input_constants.mod kinds.mod 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 machine.mod bibliography.mod kinds.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="\"Thu Oct 7 17:17:23 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 machine.mod bibliography.mod kinds.mod cp_files.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 util.mod kinds.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="\"Thu Oct 7 17:17:29 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 util.mod kinds.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 particle_types.mod atomic_kind_types.mod cell_types.mod fist_neighbor_list_types.mod exclusion_types.mod cp_para_types.mod distribution_1d_types.mod subcell_types.mod input_section_types.mod base_hooks.mod string_utilities.mod kinds.mod util.mod cp_log_handling.mod memory_utilities.mod cp_output_handling.mod qmmm_ff_fist.mod mathlib.mod cp_units.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="\"Thu Oct 7 17:17:29 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod fist_neighbor_list_types.mod exclusion_types.mod cp_para_types.mod distribution_1d_types.mod subcell_types.mod input_section_types.mod base_hooks.mod string_utilities.mod kinds.mod util.mod cp_log_handling.mod memory_utilities.mod cp_output_handling.mod qmmm_ff_fist.mod mathlib.mod cp_units.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_kind_types.mod particle_types.mod qmmm_types.mod cell_types.mod qs_energy_types.mod fist_environment_types.mod input_section_types.mod qs_environment_types.mod force_env_types.mod cp_subsys_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod mathconstants.mod particle_methods.mod kinds.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="\"Thu Oct 7 17:17:33 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_kind_types.mod particle_types.mod qmmm_types.mod cell_types.mod qs_energy_types.mod fist_environment_types.mod input_section_types.mod qs_environment_types.mod force_env_types.mod cp_subsys_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod mathconstants.mod particle_methods.mod kinds.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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qmmm_types_low.mod fist_neighbor_list_types.mod cp_para_types.mod qmmm_types.mod cp_subsys_types.mod molecule_list_types.mod particle_list_types.mod qmmmx_types.mod input_section_types.mod base_hooks.mod fist_neighbor_lists.mod kinds.mod qmmm_util.mod cp_log_handling.mod memory_utilities.mod qmmm_ff_fist.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="\"Thu Oct 7 17:17:36 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qmmm_types_low.mod fist_neighbor_list_types.mod cp_para_types.mod qmmm_types.mod cp_subsys_types.mod molecule_list_types.mod particle_list_types.mod qmmmx_types.mod input_section_types.mod base_hooks.mod fist_neighbor_lists.mod kinds.mod qmmm_util.mod cp_log_handling.mod memory_utilities.mod qmmm_ff_fist.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 particle_types.mod virial_types.mod particle_list_types.mod atomic_kind_types.mod atomic_kind_list_types.mod cell_types.mod cp_para_types.mod distribution_1d_types.mod cp_subsys_types.mod base_hooks.mod mathlib.mod message_passing.mod kinds.mod physcon.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="\"Thu Oct 7 17:17:39 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod virial_types.mod particle_list_types.mod atomic_kind_types.mod atomic_kind_list_types.mod cell_types.mod cp_para_types.mod distribution_1d_types.mod cp_subsys_types.mod base_hooks.mod mathlib.mod message_passing.mod kinds.mod physcon.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 string_utilities.mod input_constants.mod kinds.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="\"Thu Oct 7 17:17:40 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 string_utilities.mod input_constants.mod kinds.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 particle_types.mod virial_types.mod particle_list_types.mod force_env_types.mod cell_types.mod input_section_types.mod cp_subsys_types.mod base_hooks.mod mathlib.mod input_constants.mod cp_log_handling.mod machine.mod cp_units.mod particle_methods.mod cp_output_handling.mod kinds.mod cp2k_info.mod physcon.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="\"Thu Oct 7 17:17:41 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod virial_types.mod particle_list_types.mod force_env_types.mod cell_types.mod input_section_types.mod cp_subsys_types.mod base_hooks.mod mathlib.mod input_constants.mod cp_log_handling.mod machine.mod cp_units.mod particle_methods.mod cp_output_handling.mod kinds.mod cp2k_info.mod physcon.mod 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 input_constants.mod bibliography.mod kinds.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="\"Thu Oct 7 17:17:43 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_constants.mod bibliography.mod kinds.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="\"Thu Oct 7 17:17:44 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 bibliography.mod kinds.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="\"Thu Oct 7 17:17:44 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 bibliography.mod kinds.mod 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 input_section_types.mod force_env_types.mod base_hooks.mod input_constants.mod kinds.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="\"Thu Oct 7 17:17:44 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_section_types.mod force_env_types.mod base_hooks.mod input_constants.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 extended_system_types.mod input_section_types.mod simpar_types.mod parallel_rng_types.mod base_hooks.mod string_utilities.mod bibliography.mod kinds.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="\"Thu Oct 7 17:17:46 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 extended_system_types.mod input_section_types.mod simpar_types.mod parallel_rng_types.mod base_hooks.mod string_utilities.mod bibliography.mod kinds.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 extended_system_types.mod input_section_types.mod parallel_rng_types.mod base_hooks.mod string_utilities.mod bibliography.mod kinds.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="\"Thu Oct 7 17:17:46 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 extended_system_types.mod input_section_types.mod parallel_rng_types.mod base_hooks.mod string_utilities.mod bibliography.mod kinds.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 extended_system_types.mod csvr_system_types.mod al_system_types.mod input_section_types.mod gle_system_types.mod simpar_types.mod base_hooks.mod input_constants.mod kinds.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="\"Thu Oct 7 17:17:47 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 extended_system_types.mod csvr_system_types.mod al_system_types.mod input_section_types.mod gle_system_types.mod simpar_types.mod base_hooks.mod input_constants.mod kinds.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 input_constants.mod kinds.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="\"Thu Oct 7 17:17:47 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_constants.mod kinds.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="\"Thu Oct 7 17:17:48 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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="\"Thu Oct 7 17:17:48 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:541: update target 'string_table.mod' due to: string_table.o 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 topology_types.mod input_section_types.mod qmmm_types_low.mod base_hooks.mod mm_mapping_library.mod string_utilities.mod cp_log_handling.mod cp_output_handling.mod graphcon.mod kinds.mod string_table.mod periodic_table.mod util.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="\"Thu Oct 7 17:17:51 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 topology_types.mod input_section_types.mod qmmm_types_low.mod base_hooks.mod mm_mapping_library.mod string_utilities.mod cp_log_handling.mod cp_output_handling.mod graphcon.mod kinds.mod string_table.mod periodic_table.mod util.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 topology_types.mod particle_types.mod molecule_kind_types.mod atomic_kind_types.mod molecule_types.mod input_section_types.mod qmmm_types_low.mod external_potential_types.mod exclusion_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod memory_utilities.mod cp_output_handling.mod topology_util.mod kinds.mod string_table.mod physcon.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="\"Thu Oct 7 17:17:55 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 topology_types.mod particle_types.mod molecule_kind_types.mod atomic_kind_types.mod molecule_types.mod input_section_types.mod qmmm_types_low.mod external_potential_types.mod exclusion_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod memory_utilities.mod cp_output_handling.mod topology_util.mod kinds.mod string_table.mod physcon.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 topology_types.mod cell_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod mathlib.mod cp_log_handling.mod cp_units.mod memory_utilities.mod cp_output_handling.mod cell_methods.mod kinds.mod string_table.mod cp_parser_methods.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="\"Thu Oct 7 17:17:59 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 topology_types.mod cell_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod mathlib.mod cp_log_handling.mod cp_units.mod memory_utilities.mod cp_output_handling.mod cell_methods.mod kinds.mod string_table.mod cp_parser_methods.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 topology_types.mod molecule_kind_types.mod molecule_types.mod input_section_types.mod qmmm_types_low.mod base_hooks.mod string_utilities.mod cp_log_handling.mod cp_output_handling.mod kinds.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="\"Thu Oct 7 17:18:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 topology_types.mod molecule_kind_types.mod molecule_types.mod input_section_types.mod qmmm_types_low.mod base_hooks.mod string_utilities.mod cp_log_handling.mod cp_output_handling.mod kinds.mod string_table.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 '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 topology_types.mod cell_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod string_utilities.mod cp_log_handling.mod memory_utilities.mod cp_output_handling.mod cell_methods.mod kinds.mod string_table.mod cp_parser_methods.mod fparser.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="\"Thu Oct 7 17:18:01 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 topology_types.mod cell_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod string_utilities.mod cp_log_handling.mod memory_utilities.mod cp_output_handling.mod cell_methods.mod kinds.mod string_table.mod cp_parser_methods.mod fparser.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 cp_linked_list_input.mod kinds.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="\"Thu Oct 7 17:18:02 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_linked_list_input.mod kinds.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 topology_types.mod particle_types.mod atomic_kind_types.mod cell_types.mod qmmm_types_low.mod fist_neighbor_list_types.mod cp_para_types.mod input_section_types.mod base_hooks.mod string_utilities.mod fist_neighbor_lists.mod kinds.mod util.mod input_constants.mod cp_log_handling.mod periodic_table.mod memory_utilities.mod cp_output_handling.mod mathlib.mod cp_units.mod string_table.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="\"Thu Oct 7 17:18:03 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 topology_types.mod particle_types.mod atomic_kind_types.mod cell_types.mod qmmm_types_low.mod fist_neighbor_list_types.mod cp_para_types.mod input_section_types.mod base_hooks.mod string_utilities.mod fist_neighbor_lists.mod kinds.mod util.mod input_constants.mod cp_log_handling.mod periodic_table.mod memory_utilities.mod cp_output_handling.mod mathlib.mod cp_units.mod string_table.mod topology_util.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 topology_types.mod particle_types.mod force_field_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod util.mod base_hooks.mod cp_log_handling.mod cp_units.mod input_cp2k_restarts_util.mod memory_utilities.mod cp_output_handling.mod topology_generate_util.mod kinds.mod string_table.mod cp_parser_methods.mod qmmm_ff_fist.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="\"Thu Oct 7 17:18:11 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 topology_types.mod particle_types.mod force_field_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod util.mod base_hooks.mod cp_log_handling.mod cp_units.mod input_cp2k_restarts_util.mod memory_utilities.mod cp_output_handling.mod topology_generate_util.mod kinds.mod string_table.mod cp_parser_methods.mod qmmm_ff_fist.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 topology_types.mod cell_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod string_table.mod cp_units.mod memory_utilities.mod cp_output_handling.mod kinds.mod cp2k_info.mod cp_parser_methods.mod physcon.mod qmmm_ff_fist.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="\"Thu Oct 7 17:18:17 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 topology_types.mod cell_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod string_table.mod cp_units.mod memory_utilities.mod cp_output_handling.mod kinds.mod cp2k_info.mod cp_parser_methods.mod physcon.mod qmmm_ff_fist.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 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/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="\"Thu Oct 7 17:18:18 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 base_hooks.mod mathconstants.mod kinds.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 topology_types.mod particle_types.mod input_val_types.mod atomic_kind_types.mod shell_potential_types.mod cell_types.mod input_section_types.mod base_hooks.mod string_utilities.mod cp_log_handling.mod cp_units.mod memory_utilities.mod cp_linked_list_input.mod kinds.mod string_table.mod cp_parser_methods.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="\"Thu Oct 7 17:18:19 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 topology_types.mod particle_types.mod input_val_types.mod atomic_kind_types.mod shell_potential_types.mod cell_types.mod input_section_types.mod base_hooks.mod string_utilities.mod cp_log_handling.mod cp_units.mod memory_utilities.mod cp_linked_list_input.mod kinds.mod string_table.mod cp_parser_methods.mod 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 extended_system_types.mod topology_types.mod particle_types.mod cp_para_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod print_messages.mod cp_output_handling.mod kinds.mod cp_files.mod string_table.mod physcon.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="\"Thu Oct 7 17:18:20 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 extended_system_types.mod topology_types.mod particle_types.mod cp_para_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod print_messages.mod cp_output_handling.mod kinds.mod cp_files.mod string_table.mod physcon.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="\"Thu Oct 7 17:18:22 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 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/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="\"Thu Oct 7 17:18:23 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 base_hooks.mod cp_log_handling.mod kinds.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 atomic_kind_types.mod splines_types.mod pair_potential_types.mod base_hooks.mod cp_log_handling.mod string_table.mod pair_potential_util.mod splines_methods.mod kinds.mod cp_files.mod physcon.mod fparser.mod util.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="\"Thu Oct 7 17:18:23 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 atomic_kind_types.mod splines_types.mod pair_potential_types.mod base_hooks.mod cp_log_handling.mod string_table.mod pair_potential_util.mod splines_methods.mod kinds.mod cp_files.mod physcon.mod fparser.mod util.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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qmmm_types_low.mod force_field_types.mod splines_types.mod force_field_kind_types.mod molecule_kind_types.mod shell_potential_types.mod ewald_environment_types.mod external_potential_types.mod damping_dipole_types.mod input_val_types.mod input_section_types.mod pair_potential_types.mod base_hooks.mod string_utilities.mod pair_potential_coulomb.mod kinds.mod input_constants.mod cp_log_handling.mod physcon.mod mathconstants.mod atoms_input.mod memory_utilities.mod input_cp2k_binary_restarts.mod pair_potential.mod qmmm_ff_fist.mod cp_linked_list_input.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="\"Thu Oct 7 17:18:28 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qmmm_types_low.mod force_field_types.mod splines_types.mod force_field_kind_types.mod molecule_kind_types.mod shell_potential_types.mod ewald_environment_types.mod external_potential_types.mod damping_dipole_types.mod input_val_types.mod input_section_types.mod pair_potential_types.mod base_hooks.mod string_utilities.mod pair_potential_coulomb.mod kinds.mod input_constants.mod cp_log_handling.mod physcon.mod mathconstants.mod atoms_input.mod memory_utilities.mod input_cp2k_binary_restarts.mod pair_potential.mod qmmm_ff_fist.mod cp_linked_list_input.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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qmmm_types_low.mod force_field_types.mod force_field_kind_types.mod colvar_types.mod molecule_kind_types.mod shell_potential_types.mod ewald_environment_types.mod fist_nonbond_env_types.mod input_section_types.mod pair_potential_types.mod base_hooks.mod string_utilities.mod kinds.mod cp_log_handling.mod memory_utilities.mod cp_output_handling.mod force_fields_all.mod cp_units.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="\"Thu Oct 7 17:18:35 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qmmm_types_low.mod force_field_types.mod force_field_kind_types.mod colvar_types.mod molecule_kind_types.mod shell_potential_types.mod ewald_environment_types.mod fist_nonbond_env_types.mod input_section_types.mod pair_potential_types.mod base_hooks.mod string_utilities.mod kinds.mod cp_log_handling.mod memory_utilities.mod cp_output_handling.mod force_fields_all.mod cp_units.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 force_field_types.mod cp_para_types.mod force_field_kind_types.mod shell_potential_types.mod damping_dipole_types.mod input_val_types.mod input_section_types.mod pair_potential_types.mod cp_parser_types.mod base_hooks.mod string_utilities.mod kinds.mod cp_parser_methods.mod cp_log_handling.mod bibliography.mod mathconstants.mod memory_utilities.mod cp_output_handling.mod force_fields_util.mod mathlib.mod cp_units.mod cp_linked_list_input.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="\"Thu Oct 7 17:18:42 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 force_field_types.mod cp_para_types.mod force_field_kind_types.mod shell_potential_types.mod damping_dipole_types.mod input_val_types.mod input_section_types.mod pair_potential_types.mod cp_parser_types.mod base_hooks.mod string_utilities.mod kinds.mod cp_parser_methods.mod cp_log_handling.mod bibliography.mod mathconstants.mod memory_utilities.mod cp_output_handling.mod force_fields_util.mod mathlib.mod cp_units.mod cp_linked_list_input.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 topology_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod util.mod base_hooks.mod string_utilities.mod input_constants.mod cp_log_handling.mod force_fields_input.mod memory_utilities.mod cp_output_handling.mod kinds.mod string_table.mod topology_util.mod cp_parser_methods.mod qmmm_ff_fist.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="\"Thu Oct 7 17:18:47 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 topology_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod util.mod base_hooks.mod string_utilities.mod input_constants.mod cp_log_handling.mod force_fields_input.mod memory_utilities.mod cp_output_handling.mod kinds.mod string_table.mod topology_util.mod cp_parser_methods.mod qmmm_ff_fist.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 virial_types.mod particle_list_types.mod input_section_types.mod cp_result_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="\"Thu Oct 7 17:18:51 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 virial_types.mod particle_list_types.mod input_section_types.mod cp_result_types.mod base_hooks.mod kinds.mod cp_result_methods.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 mathlib.mod kinds.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="\"Thu Oct 7 17:18:51 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathlib.mod kinds.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 particle_types.mod molecule_kind_types.mod molecule_kind_list_types.mod particle_list_types.mod force_env_types.mod atomic_kind_types.mod molecule_types.mod atomic_kind_list_types.mod cell_types.mod distribution_1d_types.mod cp_subsys_types.mod base_hooks.mod message_passing.mod kinds.mod util.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="\"Thu Oct 7 17:18:52 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod molecule_kind_types.mod molecule_kind_list_types.mod particle_list_types.mod force_env_types.mod atomic_kind_types.mod molecule_types.mod atomic_kind_list_types.mod cell_types.mod distribution_1d_types.mod cp_subsys_types.mod base_hooks.mod message_passing.mod kinds.mod util.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 particle_types.mod input_enumeration_types.mod cell_types.mod mixed_energy_types.mod cp_para_types.mod force_env_types.mod input_keyword_types.mod colvar_types.mod molecule_kind_types.mod wannier_states_types.mod qs_environment_types.mod cp_subsys_types.mod particle_list_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod string_utilities.mod kinds.mod cp_parser_methods.mod input_constants.mod cp_log_handling.mod message_passing.mod kahan_sum.mod spherical_harmonics.mod mathconstants.mod memory_utilities.mod cp_output_handling.mod mixed_environment_utils.mod force_fields_util.mod rmsd.mod mathlib.mod cp_units.mod input_cp2k_colvar.mod constraint_fxd.mod fparser.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="\"Thu Oct 7 17:18:55 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod input_enumeration_types.mod cell_types.mod mixed_energy_types.mod cp_para_types.mod force_env_types.mod input_keyword_types.mod colvar_types.mod molecule_kind_types.mod wannier_states_types.mod qs_environment_types.mod cp_subsys_types.mod particle_list_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod string_utilities.mod kinds.mod cp_parser_methods.mod input_constants.mod cp_log_handling.mod message_passing.mod kahan_sum.mod spherical_harmonics.mod mathconstants.mod memory_utilities.mod cp_output_handling.mod mixed_environment_utils.mod force_fields_util.mod rmsd.mod mathlib.mod cp_units.mod input_cp2k_colvar.mod constraint_fxd.mod fparser.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 particle_types.mod molecule_types.mod cell_types.mod force_env_types.mod colvar_types.mod molecule_kind_types.mod molecule_kind_list_types.mod distribution_1d_types.mod cp_subsys_types.mod molecule_list_types.mod particle_list_types.mod base_hooks.mod string_utilities.mod kinds.mod util.mod input_constants.mod message_passing.mod memory_utilities.mod rmsd.mod mathlib.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="\"Thu Oct 7 17:19:15 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod molecule_types.mod cell_types.mod force_env_types.mod colvar_types.mod molecule_kind_types.mod molecule_kind_list_types.mod distribution_1d_types.mod cp_subsys_types.mod molecule_list_types.mod particle_list_types.mod base_hooks.mod string_utilities.mod kinds.mod util.mod input_constants.mod message_passing.mod memory_utilities.mod rmsd.mod mathlib.mod colvar_methods.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 topology_types.mod colvar_types.mod particle_types.mod molecule_kind_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod input_section_types.mod qmmm_types_low.mod base_hooks.mod input_constants.mod cp_log_handling.mod memory_utilities.mod cp_output_handling.mod colvar_methods.mod kinds.mod colvar_utils.mod qmmm_ff_fist.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="\"Thu Oct 7 17:19:19 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 topology_types.mod colvar_types.mod particle_types.mod molecule_kind_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod input_section_types.mod qmmm_types_low.mod base_hooks.mod input_constants.mod cp_log_handling.mod memory_utilities.mod cp_output_handling.mod colvar_methods.mod kinds.mod colvar_utils.mod qmmm_ff_fist.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 topology_types.mod cell_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod cp_log_handling.mod cp_units.mod memory_utilities.mod cp_output_handling.mod kinds.mod string_table.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/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="\"Thu Oct 7 17:19:24 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 topology_types.mod cell_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod cp_log_handling.mod cp_units.mod memory_utilities.mod cp_output_handling.mod kinds.mod string_table.mod cp_parser_methods.mod periodic_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 topology_types.mod colvar_types.mod input_section_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod memory_utilities.mod kinds.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="\"Thu Oct 7 17:19:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 topology_types.mod colvar_types.mod input_section_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod memory_utilities.mod kinds.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 topology_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod cp_log_handling.mod cp_units.mod input_cp2k_restarts_util.mod memory_utilities.mod cp_output_handling.mod kinds.mod string_table.mod cp_parser_methods.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="\"Thu Oct 7 17:19:27 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 topology_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod cp_log_handling.mod cp_units.mod input_cp2k_restarts_util.mod memory_utilities.mod cp_output_handling.mod kinds.mod string_table.mod cp_parser_methods.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 topology_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod cp_log_handling.mod cp_units.mod memory_utilities.mod cp_output_handling.mod kinds.mod string_table.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/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="\"Thu Oct 7 17:19:30 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 topology_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod cp_log_handling.mod cp_units.mod memory_utilities.mod cp_output_handling.mod kinds.mod string_table.mod cp_parser_methods.mod periodic_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 topology_types.mod cell_types.mod input_section_types.mod base_hooks.mod memory_utilities.mod kinds.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="\"Thu Oct 7 17:19:30 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 topology_types.mod cell_types.mod input_section_types.mod base_hooks.mod memory_utilities.mod kinds.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 topology_types.mod molecule_kind_types.mod molecule_types.mod input_section_types.mod force_field_kind_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod memory_utilities.mod cp_output_handling.mod kinds.mod string_table.mod util.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="\"Thu Oct 7 17:19:31 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 topology_types.mod molecule_kind_types.mod molecule_types.mod input_section_types.mod force_field_kind_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod memory_utilities.mod cp_output_handling.mod kinds.mod string_table.mod util.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 topology_types.mod particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qmmm_types_low.mod exclusion_types.mod cp_para_types.mod colvar_types.mod molecule_kind_types.mod input_section_types.mod base_hooks.mod mm_mapping_library.mod topology_xtl.mod kinds.mod qmmm_topology_util.mod topology_cif.mod topology_coordinate_util.mod input_constants.mod cp_log_handling.mod topology_amber.mod topology_pdb.mod topology_psf.mod atoms_input.mod cp_output_handling.mod cell_methods.mod input_cp2k_binary_restarts.mod topology_constraint_util.mod topology_cp2k.mod topology_generate_util.mod colvar_utils.mod topology_input.mod topology_gromos.mod topology_xyz.mod topology_multiple_unit_cell.mod topology_connectivity_util.mod string_table.mod topology_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="\"Thu Oct 7 17:19:39 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 topology_types.mod particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qmmm_types_low.mod exclusion_types.mod cp_para_types.mod colvar_types.mod molecule_kind_types.mod input_section_types.mod base_hooks.mod mm_mapping_library.mod topology_xtl.mod kinds.mod qmmm_topology_util.mod topology_cif.mod topology_coordinate_util.mod input_constants.mod cp_log_handling.mod topology_amber.mod topology_pdb.mod topology_psf.mod atoms_input.mod cp_output_handling.mod cell_methods.mod input_cp2k_binary_restarts.mod topology_constraint_util.mod topology_cp2k.mod topology_generate_util.mod colvar_utils.mod topology_input.mod topology_gromos.mod topology_xyz.mod topology_multiple_unit_cell.mod topology_connectivity_util.mod string_table.mod topology_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 topology_types.mod particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qmmm_types_low.mod exclusion_types.mod cp_para_types.mod molecule_kind_types.mod virial_types.mod molecule_kind_list_types.mod atprop_types.mod atomic_kind_list_types.mod cp_subsys_types.mod molecule_list_types.mod particle_list_types.mod input_section_types.mod cp_result_types.mod base_hooks.mod kinds.mod topology_coordinate_util.mod input_constants.mod topology.mod string_table.mod cp_para_env.mod topology_connectivity_util.mod colvar_methods.mod topology_util.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="\"Thu Oct 7 17:19:42 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 topology_types.mod particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qmmm_types_low.mod exclusion_types.mod cp_para_types.mod molecule_kind_types.mod virial_types.mod molecule_kind_list_types.mod atprop_types.mod atomic_kind_list_types.mod cp_subsys_types.mod molecule_list_types.mod particle_list_types.mod input_section_types.mod cp_result_types.mod base_hooks.mod kinds.mod topology_coordinate_util.mod input_constants.mod topology.mod string_table.mod cp_para_env.mod topology_connectivity_util.mod colvar_methods.mod topology_util.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 qs_kind_types.mod molecule_kind_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_subsys_types.mod cp_para_types.mod input_section_types.mod cp_subsys_types.mod external_potential_types.mod atom_types.mod base_hooks.mod cp_subsys_methods.mod cell_methods.mod kinds.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="\"Thu Oct 7 17:19:44 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod molecule_kind_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_subsys_types.mod cp_para_types.mod input_section_types.mod cp_subsys_types.mod external_potential_types.mod atom_types.mod base_hooks.mod cp_subsys_methods.mod cell_methods.mod kinds.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 '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 distribution_2d_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qs_kind_types.mod parallel_rng_types.mod molecule_kind_types.mod distribution_1d_types.mod input_section_types.mod base_hooks.mod cp_min_heap.mod cp_blacs_env.mod kinds.mod util.mod input_constants.mod cp_log_handling.mod message_passing.mod mathconstants.mod cp_array_utils.mod cp_output_handling.mod mathlib.mod machine.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="\"Thu Oct 7 17:19:46 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 distribution_2d_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qs_kind_types.mod parallel_rng_types.mod molecule_kind_types.mod distribution_1d_types.mod input_section_types.mod base_hooks.mod cp_min_heap.mod cp_blacs_env.mod kinds.mod util.mod input_constants.mod cp_log_handling.mod message_passing.mod mathconstants.mod cp_array_utils.mod cp_output_handling.mod mathlib.mod machine.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 cp2k_info.mod kinds.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="\"Thu Oct 7 17:19:52 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp2k_info.mod kinds.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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod cp_array_utils.mod kinds.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="\"Thu Oct 7 17:19:52 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod cp_array_utils.mod kinds.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="\"Thu Oct 7 17:19:53 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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_rho_set_types.mod xc_derivative_set_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod xc_functionals_utilities.mod xc_input_constants.mod cp_array_utils.mod kinds.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="\"Thu Oct 7 17:19:54 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod xc_functionals_utilities.mod xc_input_constants.mod cp_array_utils.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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod xc_functionals_utilities.mod xc_input_constants.mod bibliography.mod kinds.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="\"Thu Oct 7 17:19:57 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod xc_functionals_utilities.mod xc_input_constants.mod bibliography.mod kinds.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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod cp_array_utils.mod bibliography.mod kinds.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="\"Thu Oct 7 17:20:03 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod cp_array_utils.mod bibliography.mod kinds.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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod cp_array_utils.mod bibliography.mod kinds.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="\"Thu Oct 7 17:20:06 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod cp_array_utils.mod bibliography.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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod xc_functionals_utilities.mod xc_input_constants.mod bibliography.mod kinds.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="\"Thu Oct 7 17:20:12 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod xc_functionals_utilities.mod xc_input_constants.mod bibliography.mod kinds.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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod cp_array_utils.mod bibliography.mod kinds.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="\"Thu Oct 7 17:20:13 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod cp_array_utils.mod bibliography.mod kinds.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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathlib.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_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="\"Thu Oct 7 17:20:15 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathlib.mod mathconstants.mod kinds.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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod bibliography.mod kinds.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="\"Thu Oct 7 17:20:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod bibliography.mod kinds.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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathlib.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_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="\"Thu Oct 7 17:20:20 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathlib.mod mathconstants.mod kinds.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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod xc_xpbe_hole_t_c_lr.mod mathconstants.mod xc_xbecke_roussel.mod kinds.mod xc_xlda_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="\"Thu Oct 7 17:20:20 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod xc_xpbe_hole_t_c_lr.mod mathconstants.mod xc_xbecke_roussel.mod kinds.mod xc_xlda_hole_t_c_lr.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_rho_set_types.mod xc_derivative_set_types.mod xc_derivative_types.mod base_hooks.mod xc_functionals_utilities.mod bibliography.mod kinds.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="\"Thu Oct 7 17:20:21 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod xc_derivative_types.mod base_hooks.mod xc_functionals_utilities.mod bibliography.mod kinds.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_rho_set_types.mod xc_derivative_set_types.mod xc_derivative_types.mod base_hooks.mod xc_functionals_utilities.mod cp_array_utils.mod kinds.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="\"Thu Oct 7 17:20:22 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod xc_derivative_types.mod base_hooks.mod xc_functionals_utilities.mod cp_array_utils.mod kinds.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_rho_set_types.mod xc_derivative_set_types.mod xc_derivative_types.mod base_hooks.mod xc_functionals_utilities.mod xc_input_constants.mod kinds.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="\"Thu Oct 7 17:20:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod xc_derivative_types.mod base_hooks.mod xc_functionals_utilities.mod xc_input_constants.mod kinds.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_rho_set_types.mod xc_derivative_set_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.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_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="\"Thu Oct 7 17:20:26 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod cp_log_handling.mod kinds.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_rho_set_types.mod xc_derivative_set_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod cp_log_handling.mod xc_functionals_utilities.mod xc_input_constants.mod cp_array_utils.mod kinds.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="\"Thu Oct 7 17:20:26 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod cp_log_handling.mod xc_functionals_utilities.mod xc_input_constants.mod cp_array_utils.mod kinds.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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod xc_input_constants.mod bibliography.mod kinds.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="\"Thu Oct 7 17:20:29 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod xc_input_constants.mod bibliography.mod kinds.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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod bibliography.mod kinds.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="\"Thu Oct 7 17:20:33 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod bibliography.mod kinds.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="\"Thu Oct 7 17:20:34 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod xc_libxc_wrap.mod bibliography.mod kinds.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="\"Thu Oct 7 17:20:34 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod xc_libxc_wrap.mod bibliography.mod kinds.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_rho_set_types.mod xc_derivative_set_types.mod xc_derivative_types.mod base_hooks.mod xc_functionals_utilities.mod cp_array_utils.mod kinds.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="\"Thu Oct 7 17:20:43 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod xc_derivative_types.mod base_hooks.mod xc_functionals_utilities.mod cp_array_utils.mod kinds.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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathlib.mod mathconstants.mod bibliography.mod kinds.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="\"Thu Oct 7 17:20:45 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathlib.mod mathconstants.mod bibliography.mod kinds.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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod xc_input_constants.mod bibliography.mod kinds.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="\"Thu Oct 7 17:20:58 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod xc_input_constants.mod bibliography.mod kinds.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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod bibliography.mod kinds.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="\"Thu Oct 7 17:21:03 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod bibliography.mod kinds.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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod xc_input_constants.mod xc_functionals_utilities.mod bibliography.mod kinds.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="\"Thu Oct 7 17:21:05 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod xc_input_constants.mod xc_functionals_utilities.mod bibliography.mod kinds.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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod cp_array_utils.mod bibliography.mod kinds.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="\"Thu Oct 7 17:21:07 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod cp_array_utils.mod bibliography.mod kinds.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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod cp_log_handling.mod bibliography.mod kinds.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="\"Thu Oct 7 17:21:46 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod mathconstants.mod cp_log_handling.mod bibliography.mod kinds.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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod xc_functionals_utilities.mod xc_input_constants.mod kinds.mod xc_perdew_zunger.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="\"Thu Oct 7 17:21:47 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod xc_functionals_utilities.mod xc_input_constants.mod kinds.mod xc_perdew_zunger.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_rho_set_types.mod xc_derivative_set_types.mod xc_derivative_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="\"Thu Oct 7 17:21:47 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod xc_derivative_types.mod base_hooks.mod xc_functionals_utilities.mod kinds.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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod xc_functionals_utilities.mod cp_array_utils.mod kinds.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="\"Thu Oct 7 17:21:48 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod xc_functionals_utilities.mod cp_array_utils.mod kinds.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 xc_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod base_hooks.mod xc_optx.mod xc_ke_gga.mod xc_vwn.mod kinds.mod xc_xbecke88.mod xc_xbecke88_long_range.mod xc_perdew_zunger.mod xc_xbeef.mod xc_xbr_pbe_lda_hole_t_c_lr.mod xc_pade.mod xc_tfw.mod xc_xpbe_hole_t_c_lr.mod xc_perdew_wang.mod xc_hcth.mod xc_xbecke_roussel.mod xc_exchange_gga.mod xc_b97.mod xc_lyp_adiabatic.mod xc_libxc.mod xc_thomas_fermi.mod xc_xlda_hole_t_c_lr.mod xc_xwpbe.mod xc_pbe.mod xc_lyp.mod xc_sr_lda.mod xc_xbecke88_lr_adiabatic.mod xc_tpss.mod xc_perdew86.mod xc_cs1.mod xc_xalpha.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="\"Thu Oct 7 17:21:50 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 xc_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod base_hooks.mod xc_optx.mod xc_ke_gga.mod xc_vwn.mod kinds.mod xc_xbecke88.mod xc_xbecke88_long_range.mod xc_perdew_zunger.mod xc_xbeef.mod xc_xbr_pbe_lda_hole_t_c_lr.mod xc_pade.mod xc_tfw.mod xc_xpbe_hole_t_c_lr.mod xc_perdew_wang.mod xc_hcth.mod xc_xbecke_roussel.mod xc_exchange_gga.mod xc_b97.mod xc_lyp_adiabatic.mod xc_libxc.mod xc_thomas_fermi.mod xc_xlda_hole_t_c_lr.mod xc_xwpbe.mod xc_pbe.mod xc_lyp.mod xc_sr_lda.mod xc_xbecke88_lr_adiabatic.mod xc_tpss.mod xc_perdew86.mod xc_cs1.mod xc_xalpha.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 xc_rho_set_types.mod xc_derivative_set_types.mod pw_pool_types.mod pw_types.mod pw_grid_types.mod xc_derivative_types.mod input_section_types.mod base_hooks.mod xc_derivative_desc.mod kinds.mod cp_log_handling.mod message_passing.mod pw_spline_utils.mod kahan_sum.mod pw_methods.mod xc_derivatives.mod xc_input_constants.mod cp_array_utils.mod cp_linked_list_xc_deriv.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="\"Thu Oct 7 17:21:51 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 xc_rho_set_types.mod xc_derivative_set_types.mod pw_pool_types.mod pw_types.mod pw_grid_types.mod xc_derivative_types.mod input_section_types.mod base_hooks.mod xc_derivative_desc.mod kinds.mod cp_log_handling.mod message_passing.mod pw_spline_utils.mod kahan_sum.mod pw_methods.mod xc_derivatives.mod xc_input_constants.mod cp_array_utils.mod cp_linked_list_xc_deriv.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 xc_rho_set_types.mod xc_derivative_set_types.mod pw_pool_types.mod pw_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod xc_derivatives.mod xc.mod kinds.mod cp_linked_list_xc_deriv.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="\"Thu Oct 7 17:22:04 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 xc_rho_set_types.mod xc_derivative_set_types.mod pw_pool_types.mod pw_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod xc_derivatives.mod xc.mod kinds.mod cp_linked_list_xc_deriv.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 xc_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod atom_types.mod xc_derivative_types.mod base_hooks.mod atom_utils.mod input_constants.mod mathconstants.mod xc_derivatives.mod xc_atom.mod kinds.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="\"Thu Oct 7 17:22:08 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 xc_rho_set_types.mod xc_derivative_set_types.mod input_section_types.mod atom_types.mod xc_derivative_types.mod base_hooks.mod atom_utils.mod input_constants.mod mathconstants.mod xc_derivatives.mod xc_atom.mod kinds.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="\"Thu Oct 7 17:22:14 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 input_val_types.mod cp_para_types.mod input_section_types.mod input_keyword_types.mod cp_parser_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod xc_input_constants.mod cp_units.mod memory_utilities.mod kinds.mod input_parsing.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="\"Thu Oct 7 17:22:15 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_val_types.mod cp_para_types.mod input_section_types.mod input_keyword_types.mod cp_parser_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod xc_input_constants.mod cp_units.mod memory_utilities.mod kinds.mod input_parsing.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 input_section_types.mod atom_types.mod input_cp2k_check.mod base_hooks.mod atom_utils.mod input_constants.mod mathconstants.mod xc_derivatives.mod xc_libxc.mod physcon.mod kinds.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_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="\"Thu Oct 7 17:22:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_section_types.mod atom_types.mod input_cp2k_check.mod base_hooks.mod atom_utils.mod input_constants.mod mathconstants.mod xc_derivatives.mod xc_libxc.mod physcon.mod kinds.mod cp_files.mod periodic_table.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 atom_utils.mod input_constants.mod atom_xc.mod atom_optimization.mod kinds.mod atom_output.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="\"Thu Oct 7 17:22:19 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 atom_utils.mod input_constants.mod atom_xc.mod atom_optimization.mod kinds.mod atom_output.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 string_utilities.mod input_constants.mod message_passing.mod cp_fm_basic_linalg.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/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="\"Thu Oct 7 17:22:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 string_utilities.mod input_constants.mod message_passing.mod cp_fm_basic_linalg.mod kinds.mod cp_dbcsr_operations.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 '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 cp_fm_types.mod qs_environment_types.mod base_hooks.mod cp_gemm_interface.mod cp_fm_cholesky.mod cp_fm_basic_linalg.mod kinds.mod cp_blacs_env.mod cp_fm_struct.mod physcon.mod cp_fm_diag.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="\"Thu Oct 7 17:22:26 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_fm_types.mod qs_environment_types.mod base_hooks.mod cp_gemm_interface.mod cp_fm_cholesky.mod cp_fm_basic_linalg.mod kinds.mod cp_blacs_env.mod cp_fm_struct.mod physcon.mod cp_fm_diag.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 mathlib.mod atom_utils.mod input_constants.mod lapack.mod mathconstants.mod ai_onecenter.mod physcon.mod qs_grid_atom.mod kinds.mod dkh_main.mod periodic_table.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="\"Thu Oct 7 17:22:39 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathlib.mod atom_utils.mod input_constants.mod lapack.mod mathconstants.mod ai_onecenter.mod physcon.mod qs_grid_atom.mod kinds.mod dkh_main.mod periodic_table.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 powell.mod atom_utils.mod input_constants.mod lapack.mod atom_electronic_structure.mod mathconstants.mod physcon.mod cp_files.mod kinds.mod atom_operators.mod atom_output.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="\"Thu Oct 7 17:22:49 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 powell.mod atom_utils.mod input_constants.mod lapack.mod atom_electronic_structure.mod mathconstants.mod physcon.mod cp_files.mod kinds.mod atom_operators.mod atom_output.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 rel_control_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod external_potential_types.mod input_section_types.mod atom_types.mod base_hooks.mod kinds.mod input_constants.mod atom_electronic_structure.mod atom_operators.mod physcon.mod periodic_table.mod mathconstants.mod ai_onecenter.mod qs_grid_atom.mod atom_utils.mod atom_fit.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="\"Thu Oct 7 17:23:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 rel_control_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod external_potential_types.mod input_section_types.mod atom_types.mod base_hooks.mod kinds.mod input_constants.mod atom_electronic_structure.mod atom_operators.mod physcon.mod periodic_table.mod mathconstants.mod ai_onecenter.mod qs_grid_atom.mod atom_utils.mod atom_fit.mod 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 particle_types.mod pwdft_environment_types.mod atomic_kind_types.mod cell_types.mod qs_subsys_types.mod qs_kind_types.mod cp_para_types.mod external_potential_types.mod input_section_types.mod atom_types.mod atom_upf.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod mathconstants.mod qs_grid_atom.mod cp_output_handling.mod atom_utils.mod atom_kind_orbitals.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="\"Thu Oct 7 17:23:08 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod pwdft_environment_types.mod atomic_kind_types.mod cell_types.mod qs_subsys_types.mod qs_kind_types.mod cp_para_types.mod external_potential_types.mod input_section_types.mod atom_types.mod atom_upf.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod mathconstants.mod qs_grid_atom.mod cp_output_handling.mod atom_utils.mod atom_kind_orbitals.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 mathlib.mod mathconstants.mod kinds.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="\"Thu Oct 7 17:23:08 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathlib.mod mathconstants.mod kinds.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 base_hooks.mod kinds.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="\"Thu Oct 7 17:23:14 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 base_hooks.mod kinds.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 string_utilities.mod kinds.mod bibliography.mod spglib_f08.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="\"Thu Oct 7 17:23:14 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 string_utilities.mod kinds.mod bibliography.mod spglib_f08.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 cell_types.mod input_section_types.mod base_hooks.mod molsym.mod cp_log_handling.mod string_utilities.mod cp_output_handling.mod kinds.mod physcon.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="\"Thu Oct 7 17:23:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cell_types.mod input_section_types.mod base_hooks.mod molsym.mod cp_log_handling.mod string_utilities.mod cp_output_handling.mod kinds.mod physcon.mod cryssym.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 particle_types.mod pwdft_environment_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qs_subsys_types.mod qs_kind_types.mod cp_para_types.mod molecule_kind_types.mod virial_types.mod distribution_1d_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod qs_subsys_methods.mod distribution_methods.mod kinds.mod header.mod cp_log_handling.mod sirius_interface.mod cp_symmetry.mod machine.mod particle_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="\"Thu Oct 7 17:23:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod pwdft_environment_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qs_subsys_types.mod qs_kind_types.mod cp_para_types.mod molecule_kind_types.mod virial_types.mod distribution_1d_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod qs_subsys_methods.mod distribution_methods.mod kinds.mod header.mod cp_log_handling.mod sirius_interface.mod cp_symmetry.mod machine.mod particle_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_section_types.mod input_keyword_types.mod base_hooks.mod cp_units.mod cp_output_handling.mod bibliography.mod kinds.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="\"Thu Oct 7 17:23:18 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_section_types.mod input_keyword_types.mod base_hooks.mod cp_units.mod cp_output_handling.mod bibliography.mod kinds.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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.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_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="\"Thu Oct 7 17:23:18 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_output_handling.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_val_types.mod cell_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod pw_spline_utils.mod cp_spline_utils.mod cp_units.mod cp_output_handling.mod cp_eri_mme_interface.mod bibliography.mod kinds.mod input_cp2k_subsys.mod input_cp2k_mm.mod input_cp2k_poisson.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="\"Thu Oct 7 17:23:19 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_val_types.mod cell_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod pw_spline_utils.mod cp_spline_utils.mod cp_units.mod cp_output_handling.mod cp_eri_mme_interface.mod bibliography.mod kinds.mod input_cp2k_subsys.mod input_cp2k_mm.mod input_cp2k_poisson.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_section_types.mod input_keyword_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="\"Thu Oct 7 17:23:21 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_section_types.mod input_keyword_types.mod base_hooks.mod bibliography.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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_units.mod cp_output_handling.mod bibliography.mod kinds.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="\"Thu Oct 7 17:23:21 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_units.mod cp_output_handling.mod bibliography.mod kinds.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_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_units.mod input_cp2k_dft.mod input_cp2k_atprop.mod input_cp2k_loc.mod cp_output_handling.mod bibliography.mod input_cp2k_xc.mod kinds.mod input_cp2k_resp.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="\"Thu Oct 7 17:23:22 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_units.mod input_cp2k_dft.mod input_cp2k_atprop.mod input_cp2k_loc.mod cp_output_handling.mod bibliography.mod input_cp2k_xc.mod kinds.mod input_cp2k_resp.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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_output_handling.mod bibliography.mod kinds.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="\"Thu Oct 7 17:23:24 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_output_handling.mod bibliography.mod kinds.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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod cp_output_handling.mod kinds.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="\"Thu Oct 7 17:23:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod cp_output_handling.mod kinds.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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_output_handling.mod bibliography.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="\"Thu Oct 7 17:23:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_output_handling.mod bibliography.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_keyword_types.mod input_val_types.mod input_section_types.mod base_hooks.mod input_cp2k_nnp.mod string_utilities.mod input_cp2k_eip.mod input_cp2k_qmmm.mod input_cp2k_properties_dft.mod kinds.mod input_cp2k_subsys.mod input_cp2k_mixed.mod input_constants.mod input_cp2k_pwdft.mod cp_output_handling.mod input_cp2k_embed.mod cp_units.mod input_cp2k_dft.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_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="\"Thu Oct 7 17:23:26 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_keyword_types.mod input_val_types.mod input_section_types.mod base_hooks.mod input_cp2k_nnp.mod string_utilities.mod input_cp2k_eip.mod input_cp2k_qmmm.mod input_cp2k_properties_dft.mod kinds.mod input_cp2k_subsys.mod input_cp2k_mixed.mod input_constants.mod input_cp2k_pwdft.mod cp_output_handling.mod input_cp2k_embed.mod cp_units.mod input_cp2k_dft.mod input_cp2k_mm.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 '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 particle_types.mod atomic_kind_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod pw_grid_types.mod qs_rho_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod bibliography.mod physcon.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="\"Thu Oct 7 17:23:27 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod pw_grid_types.mod qs_rho_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod bibliography.mod physcon.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 '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 input_enumeration_types.mod cp_para_types.mod cp_fm_types.mod force_env_types.mod input_keyword_types.mod parallel_rng_types.mod global_types.mod input_section_types.mod base_hooks.mod string_utilities.mod orbital_transformation_matrices.mod cp_fm_struct.mod gamma.mod cp_files.mod kinds.mod header.mod input_constants.mod cp_log_handling.mod message_passing.mod cp_fm_diag_utils.mod input_cp2k_global.mod bibliography.mod cp2k_info.mod physcon.mod fft_tools.mod cp_error_handling.mod cp_output_handling.mod timings.mod orbital_pointers.mod cp_fm_diag.mod machine.mod voronoi_interface.mod reference_manager.mod timings_report.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="\"Thu Oct 7 17:23:29 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_enumeration_types.mod cp_para_types.mod cp_fm_types.mod force_env_types.mod input_keyword_types.mod parallel_rng_types.mod global_types.mod input_section_types.mod base_hooks.mod string_utilities.mod orbital_transformation_matrices.mod cp_fm_struct.mod gamma.mod cp_files.mod kinds.mod header.mod input_constants.mod cp_log_handling.mod message_passing.mod cp_fm_diag_utils.mod input_cp2k_global.mod bibliography.mod cp2k_info.mod physcon.mod fft_tools.mod cp_error_handling.mod cp_output_handling.mod timings.mod orbital_pointers.mod cp_fm_diag.mod machine.mod voronoi_interface.mod reference_manager.mod timings_report.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 input_section_types.mod cp_para_types.mod cp_parser_types.mod base_hooks.mod cp_units.mod input_parsing.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="\"Thu Oct 7 17:23:31 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_section_types.mod cp_para_types.mod cp_parser_types.mod base_hooks.mod cp_units.mod input_parsing.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 particle_types.mod molecule_kind_types.mod atomic_kind_types.mod eip_environment_types.mod molecule_types.mod cell_types.mod cp_para_types.mod input_section_types.mod distribution_1d_types.mod cp_subsys_types.mod base_hooks.mod cp_subsys_methods.mod particle_methods.mod cell_methods.mod distribution_methods.mod kinds.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="\"Thu Oct 7 17:23:31 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod molecule_kind_types.mod atomic_kind_types.mod eip_environment_types.mod molecule_types.mod cell_types.mod cp_para_types.mod input_section_types.mod distribution_1d_types.mod cp_subsys_types.mod base_hooks.mod cp_subsys_methods.mod particle_methods.mod cell_methods.mod distribution_methods.mod kinds.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 atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod qs_dftb_types.mod external_potential_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod string_utilities.mod kinds.mod cp_files.mod cp_parser_methods.mod input_constants.mod cp_log_handling.mod message_passing.mod physcon.mod mathconstants.mod cp_output_handling.mod qs_dftb_utils.mod qmmm_ff_fist.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="\"Thu Oct 7 17:23:33 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod qs_dftb_types.mod external_potential_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod string_utilities.mod kinds.mod cp_files.mod cp_parser_methods.mod input_constants.mod cp_log_handling.mod message_passing.mod physcon.mod mathconstants.mod cp_output_handling.mod qs_dftb_utils.mod qmmm_ff_fist.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="\"Thu Oct 7 17:23:36 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_types.f90 /build/cp2k-Q381vr/cp2k-8.1/src/dbcsrx/hash_table.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 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/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="\"Thu Oct 7 17:23:36 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_types.f90 /build/cp2k-Q381vr/cp2k-8.1/src/dbcsrx/hash_table.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod message_passing.mod kinds.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/arnoldi/arnoldi_data_manipulation.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 arnoldi_types.mod base_hooks.mod kinds.mod dbcsr_vector.mod util.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="\"Thu Oct 7 17:23:47 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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/arnoldi/arnoldi_data_manipulation.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 arnoldi_types.mod base_hooks.mod kinds.mod dbcsr_vector.mod util.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="\"Thu Oct 7 17:23:50 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 message_passing.mod arnoldi_geev.mod kinds.mod dbcsr_vector.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="\"Thu Oct 7 17:23:53 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 message_passing.mod arnoldi_geev.mod kinds.mod dbcsr_vector.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 message_passing.mod arnoldi_data_methods.mod arnoldi_methods.mod kinds.mod dbcsr_vector.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="\"Thu Oct 7 17:24:09 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 message_passing.mod arnoldi_data_methods.mod arnoldi_methods.mod kinds.mod dbcsr_vector.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 arnoldi_api.mod pao_input.mod kinds.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="\"Thu Oct 7 17:24:11 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 arnoldi_api.mod pao_input.mod kinds.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 mathlib.mod kinds.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="\"Thu Oct 7 17:24:12 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathlib.mod kinds.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 util.mod kinds.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="\"Thu Oct 7 17:24:15 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 util.mod kinds.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 message_passing.mod bibliography.mod kinds.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="\"Thu Oct 7 17:24:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 message_passing.mod bibliography.mod kinds.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 mathlib.mod submatrix_dissection.mod input_constants.mod cp_log_handling.mod machine.mod mathconstants.mod message_passing.mod arnoldi_api.mod bibliography.mod kinds.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="\"Thu Oct 7 17:24:21 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathlib.mod submatrix_dissection.mod input_constants.mod cp_log_handling.mod machine.mod mathconstants.mod message_passing.mod arnoldi_api.mod bibliography.mod kinds.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 qs_kind_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_environment_types.mod base_hooks.mod mathlib.mod mathconstants.mod ao_util.mod ai_overlap.mod kinds.mod orbital_pointers.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="\"Thu Oct 7 17:24:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_environment_types.mod base_hooks.mod mathlib.mod mathconstants.mod ao_util.mod ai_overlap.mod kinds.mod orbital_pointers.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 dm_ls_scf_types.mod qs_kind_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod pao_types.mod cell_types.mod qs_environment_types.mod base_hooks.mod orbital_pointers.mod machine.mod message_passing.mod arnoldi_api.mod pao_param_fock.mod kinds.mod iterate_matrix.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="\"Thu Oct 7 17:24:29 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 dm_ls_scf_types.mod qs_kind_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod pao_types.mod cell_types.mod qs_environment_types.mod base_hooks.mod orbital_pointers.mod machine.mod message_passing.mod arnoldi_api.mod pao_param_fock.mod kinds.mod iterate_matrix.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 qs_kind_types.mod basis_set_types.mod pao_types.mod qs_environment_types.mod base_hooks.mod mathlib.mod kinds.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="\"Thu Oct 7 17:24:32 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod basis_set_types.mod pao_types.mod qs_environment_types.mod base_hooks.mod mathlib.mod kinds.mod pao_potentials.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 qs_kind_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_environment_types.mod base_hooks.mod mathlib.mod mathconstants.mod ai_overlap.mod kinds.mod orbital_pointers.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="\"Thu Oct 7 17:24:38 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_environment_types.mod base_hooks.mod mathlib.mod mathconstants.mod ai_overlap.mod kinds.mod orbital_pointers.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 qs_kind_types.mod basis_set_types.mod qs_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/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="\"Thu Oct 7 17:24:46 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod basis_set_types.mod qs_environment_types.mod base_hooks.mod kinds.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod qs_environment_types.mod pao_types.mod base_hooks.mod pao_input.mod kinds.mod message_passing.mod pao_param_fock.mod pao_linpot_rotinv.mod pao_potentials.mod mathlib.mod machine.mod pao_linpot_full.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="\"Thu Oct 7 17:24:47 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod qs_environment_types.mod pao_types.mod base_hooks.mod pao_input.mod kinds.mod message_passing.mod pao_param_fock.mod pao_linpot_rotinv.mod pao_potentials.mod mathlib.mod machine.mod pao_linpot_full.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 pao_types.mod qs_environment_types.mod base_hooks.mod pao_param_gth.mod cp_log_handling.mod message_passing.mod pao_param_exp.mod pao_input.mod pao_param_linpot.mod kinds.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="\"Thu Oct 7 17:24:52 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pao_types.mod qs_environment_types.mod base_hooks.mod pao_param_gth.mod cp_log_handling.mod message_passing.mod pao_param_exp.mod pao_input.mod pao_param_linpot.mod kinds.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 machine.mod cp_log_handling.mod message_passing.mod kinds.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="\"Thu Oct 7 17:24:55 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 machine.mod cp_log_handling.mod message_passing.mod kinds.mod cp_files.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod dm_ls_scf_types.mod pao_types.mod input_section_types.mod base_hooks.mod pao_input.mod kinds.mod cp_files.mod cp_log_handling.mod message_passing.mod pao_param.mod physcon.mod cp_output_handling.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="\"Thu Oct 7 17:24:56 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod dm_ls_scf_types.mod pao_types.mod input_section_types.mod base_hooks.mod pao_input.mod kinds.mod cp_files.mod cp_log_handling.mod message_passing.mod pao_param.mod physcon.mod cp_output_handling.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 cp_control_types.mod pw_pool_types.mod pw_types.mod qs_energy_types.mod cell_types.mod qs_rho_types.mod pw_env_types.mod pw_grid_types.mod qs_subsys_types.mod qs_environment_types.mod base_hooks.mod pw_methods.mod mathconstants.mod message_passing.mod kahan_sum.mod kinds.mod physcon.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="\"Thu Oct 7 17:24:59 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_control_types.mod pw_pool_types.mod pw_types.mod qs_energy_types.mod cell_types.mod qs_rho_types.mod pw_env_types.mod pw_grid_types.mod qs_subsys_types.mod qs_environment_types.mod base_hooks.mod pw_methods.mod mathconstants.mod message_passing.mod kahan_sum.mod kinds.mod physcon.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 particle_types.mod mp2_types.mod hfx_types.mod cell_types.mod base_hooks.mod input_constants.mod mathconstants.mod libint_wrapper.mod t_c_g0.mod gamma.mod kinds.mod t_sh_p_s_c.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="\"Thu Oct 7 17:25:01 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod mp2_types.mod hfx_types.mod cell_types.mod base_hooks.mod input_constants.mod mathconstants.mod libint_wrapper.mod t_c_g0.mod gamma.mod kinds.mod t_sh_p_s_c.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 particle_types.mod hfx_types.mod cell_types.mod cp_para_types.mod parallel_rng_types.mod base_hooks.mod input_constants.mod message_passing.mod hfx_pair_list_methods.mod kinds.mod cp_files.mod util.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="\"Thu Oct 7 17:25:04 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod hfx_types.mod cell_types.mod cp_para_types.mod parallel_rng_types.mod base_hooks.mod input_constants.mod message_passing.mod hfx_pair_list_methods.mod kinds.mod cp_files.mod util.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="\"Thu Oct 7 17:25:11 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 particle_types.mod cp_control_types.mod hfx_types.mod atomic_kind_types.mod cp_para_types.mod qs_environment_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/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="\"Thu Oct 7 17:25:59 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod cp_control_types.mod hfx_types.mod atomic_kind_types.mod cp_para_types.mod qs_environment_types.mod base_hooks.mod message_passing.mod kinds.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="\"Thu Oct 7 17:26:02 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_constants.mod mathconstants.mod libint_wrapper.mod kinds.mod t_c_g0.mod gamma.mod hfx_contraction_methods.mod orbital_pointers.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="\"Thu Oct 7 17:27:03 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_constants.mod mathconstants.mod libint_wrapper.mod kinds.mod t_c_g0.mod gamma.mod hfx_contraction_methods.mod orbital_pointers.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 qs_kind_types.mod basis_set_types.mod hfx_types.mod qs_environment_types.mod base_hooks.mod powell.mod machine.mod ao_util.mod libint_wrapper.mod hfx_libint_interface.mod kinds.mod orbital_pointers.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="\"Thu Oct 7 17:27:14 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod basis_set_types.mod hfx_types.mod qs_environment_types.mod base_hooks.mod powell.mod machine.mod ao_util.mod libint_wrapper.mod hfx_libint_interface.mod kinds.mod orbital_pointers.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 particle_types.mod atomic_kind_types.mod cell_types.mod cp_control_types.mod cp_para_types.mod qs_ks_types.mod kpoint_types.mod qs_environment_types.mod hfx_types.mod input_section_types.mod base_hooks.mod hfx_load_balance_methods.mod hfx_pair_list_methods.mod gamma.mod cp_files.mod kinds.mod hfx_contract_block.mod hfx_communication.mod util.mod input_constants.mod cp_log_handling.mod message_passing.mod t_c_g0.mod bibliography.mod hfx_screening_methods.mod mathconstants.mod cp_output_handling.mod hfx_compression_methods.mod orbital_pointers.mod machine.mod libint_wrapper.mod hfx_libint_interface.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="\"Thu Oct 7 17:27:19 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod cp_control_types.mod cp_para_types.mod qs_ks_types.mod kpoint_types.mod qs_environment_types.mod hfx_types.mod input_section_types.mod base_hooks.mod hfx_load_balance_methods.mod hfx_pair_list_methods.mod gamma.mod cp_files.mod kinds.mod hfx_contract_block.mod hfx_communication.mod util.mod input_constants.mod cp_log_handling.mod message_passing.mod t_c_g0.mod bibliography.mod hfx_screening_methods.mod mathconstants.mod cp_output_handling.mod hfx_compression_methods.mod orbital_pointers.mod machine.mod libint_wrapper.mod hfx_libint_interface.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 particle_types.mod basis_set_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_ks_types.mod kpoint_types.mod task_list_types.mod base_hooks.mod ao_util.mod kinds.mod util.mod grid_api.mod message_passing.mod gaussian_gridlevels.mod memory_utilities.mod particle_methods.mod cube_utils.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="\"Thu Oct 7 17:27:32 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_ks_types.mod kpoint_types.mod task_list_types.mod base_hooks.mod ao_util.mod kinds.mod util.mod grid_api.mod message_passing.mod gaussian_gridlevels.mod memory_utilities.mod particle_methods.mod cube_utils.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_types.mod input_section_types.mod pw_env_types.mod realspace_grid_types.mod base_hooks.mod pw_methods.mod cp_log_handling.mod cp_spline_utils.mod gaussian_gridlevels.mod kinds.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="\"Thu Oct 7 17:27:42 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_types.mod input_section_types.mod pw_env_types.mod realspace_grid_types.mod base_hooks.mod pw_methods.mod cp_log_handling.mod cp_spline_utils.mod gaussian_gridlevels.mod kinds.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_fm_types.mod qs_ks_types.mod qs_environment_types.mod external_potential_types.mod task_list_types.mod lri_environment_types.mod base_hooks.mod ao_util.mod kinds.mod grid_api.mod input_constants.mod task_list_methods.mod gaussian_gridlevels.mod rs_pw_interface.mod pw_methods.mod memory_utilities.mod orbital_pointers.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_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="\"Thu Oct 7 17:27:43 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_fm_types.mod qs_ks_types.mod qs_environment_types.mod external_potential_types.mod task_list_types.mod lri_environment_types.mod base_hooks.mod ao_util.mod kinds.mod grid_api.mod input_constants.mod task_list_methods.mod gaussian_gridlevels.mod rs_pw_interface.mod pw_methods.mod memory_utilities.mod orbital_pointers.mod cube_utils.mod cp_dbcsr_operations.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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod pw_grid_types.mod cp_fm_types.mod qs_environment_types.mod pw_poisson_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod qs_collocate_density.mod pw_methods.mod mathconstants.mod cp_output_handling.mod pw_poisson_methods.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="\"Thu Oct 7 17:27:48 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod pw_grid_types.mod cp_fm_types.mod qs_environment_types.mod pw_poisson_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod qs_collocate_density.mod pw_methods.mod mathconstants.mod cp_output_handling.mod pw_poisson_methods.mod cp_dbcsr_operations.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 mathconstants.mod input_constants.mod kinds.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="\"Thu Oct 7 17:27:50 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathconstants.mod input_constants.mod kinds.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 xc_rho_set_types.mod xc_derivative_set_types.mod basis_set_types.mod atomic_kind_types.mod paw_proj_set_types.mod qs_kind_types.mod cp_control_types.mod qs_local_rho_types.mod cp_para_types.mod qs_linres_types.mod qs_rho_atom_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod qs_harmonics_atom.mod kinds.mod util.mod input_constants.mod message_passing.mod xc_derivatives.mod memory_utilities.mod qs_grid_atom.mod xc_atom.mod orbital_pointers.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="\"Thu Oct 7 17:27:52 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 xc_rho_set_types.mod xc_derivative_set_types.mod basis_set_types.mod atomic_kind_types.mod paw_proj_set_types.mod qs_kind_types.mod cp_control_types.mod qs_local_rho_types.mod cp_para_types.mod qs_linres_types.mod qs_rho_atom_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod qs_harmonics_atom.mod kinds.mod util.mod input_constants.mod message_passing.mod xc_derivatives.mod memory_utilities.mod qs_grid_atom.mod xc_atom.mod orbital_pointers.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 particle_types.mod atomic_kind_types.mod cell_types.mod admm_types.mod cp_control_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod hfx_types.mod input_section_types.mod qs_force_types.mod base_hooks.mod hfx_load_balance_methods.mod hfx_pair_list_methods.mod gamma.mod cp_files.mod kinds.mod hfx_communication.mod util.mod input_constants.mod cp_log_handling.mod message_passing.mod t_c_g0.mod hfx_screening_methods.mod mathconstants.mod cp_output_handling.mod hfx_compression_methods.mod orbital_pointers.mod machine.mod libint_wrapper.mod hfx_libint_interface.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="\"Thu Oct 7 17:28:02 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod admm_types.mod cp_control_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod hfx_types.mod input_section_types.mod qs_force_types.mod base_hooks.mod hfx_load_balance_methods.mod hfx_pair_list_methods.mod gamma.mod cp_files.mod kinds.mod hfx_communication.mod util.mod input_constants.mod cp_log_handling.mod message_passing.mod t_c_g0.mod hfx_screening_methods.mod mathconstants.mod cp_output_handling.mod hfx_compression_methods.mod orbital_pointers.mod machine.mod libint_wrapper.mod hfx_libint_interface.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 virial_types.mod pw_pool_types.mod pw_types.mod qs_dispersion_types.mod cp_para_types.mod pw_grid_types.mod base_hooks.mod pw_methods.mod input_constants.mod mathconstants.mod message_passing.mod bibliography.mod kinds.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="\"Thu Oct 7 17:28:19 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 virial_types.mod pw_pool_types.mod pw_types.mod qs_dispersion_types.mod cp_para_types.mod pw_grid_types.mod base_hooks.mod pw_methods.mod input_constants.mod mathconstants.mod message_passing.mod bibliography.mod kinds.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 virial_types.mod cp_control_types.mod pw_pool_types.mod pw_types.mod qs_dispersion_types.mod cell_types.mod qs_rho_types.mod cp_para_types.mod input_section_types.mod pw_env_types.mod qs_ks_types.mod base_hooks.mod pw_methods.mod input_constants.mod pw_grids.mod xc.mod kinds.mod qs_dispersion_nonloc.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="\"Thu Oct 7 17:28:22 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 virial_types.mod cp_control_types.mod pw_pool_types.mod pw_types.mod qs_dispersion_types.mod cell_types.mod qs_rho_types.mod cp_para_types.mod input_section_types.mod pw_env_types.mod qs_ks_types.mod base_hooks.mod pw_methods.mod input_constants.mod pw_grids.mod xc.mod kinds.mod qs_dispersion_nonloc.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 cp_control_types.mod pw_types.mod qs_energy_types.mod qs_rho_types.mod cp_para_types.mod input_section_types.mod qs_environment_types.mod qs_ks_types.mod base_hooks.mod input_constants.mod xc_adiabatic_methods.mod qs_vxc_atom.mod hfx_derivatives.mod kinds.mod qs_vxc.mod hfx_communication.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="\"Thu Oct 7 17:28:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_control_types.mod pw_types.mod qs_energy_types.mod qs_rho_types.mod cp_para_types.mod input_section_types.mod qs_environment_types.mod qs_ks_types.mod base_hooks.mod input_constants.mod xc_adiabatic_methods.mod qs_vxc_atom.mod hfx_derivatives.mod kinds.mod qs_vxc.mod hfx_communication.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 qs_kind_types.mod particle_types.mod basis_set_types.mod qs_neighbor_list_types.mod block_p_types.mod sap_kind_types.mod paw_proj_set_types.mod base_hooks.mod mathconstants.mod orbital_transformation_matrices.mod ao_util.mod ai_overlap.mod kinds.mod orbital_pointers.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="\"Thu Oct 7 17:28:27 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod basis_set_types.mod qs_neighbor_list_types.mod block_p_types.mod sap_kind_types.mod paw_proj_set_types.mod base_hooks.mod mathconstants.mod orbital_transformation_matrices.mod ao_util.mod ai_overlap.mod kinds.mod orbital_pointers.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 basis_set_types.mod atomic_kind_types.mod paw_proj_set_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_rho_atom_types.mod qs_oce_types.mod kpoint_types.mod qs_environment_types.mod sap_kind_types.mod base_hooks.mod qs_harmonics_atom.mod kinds.mod qs_oce_methods.mod util.mod message_passing.mod spherical_harmonics.mod lebedev.mod mathconstants.mod memory_utilities.mod qs_grid_atom.mod whittaker.mod orbital_pointers.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="\"Thu Oct 7 17:28:33 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 basis_set_types.mod atomic_kind_types.mod paw_proj_set_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_rho_atom_types.mod qs_oce_types.mod kpoint_types.mod qs_environment_types.mod sap_kind_types.mod base_hooks.mod qs_harmonics_atom.mod kinds.mod qs_oce_methods.mod util.mod message_passing.mod spherical_harmonics.mod lebedev.mod mathconstants.mod memory_utilities.mod qs_grid_atom.mod whittaker.mod orbital_pointers.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 cp_fm_basic_linalg.mod kinds.mod cp_blacs_env.mod cp_fm_struct.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="\"Thu Oct 7 17:28:44 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_fm_basic_linalg.mod kinds.mod cp_blacs_env.mod cp_fm_struct.mod cp_dbcsr_operations.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 distribution_2d_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod paw_proj_set_types.mod qs_kind_types.mod almo_scf_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_ks_types.mod qs_dftb_types.mod kpoint_types.mod distribution_1d_types.mod ewald_environment_types.mod qs_environment_types.mod external_potential_types.mod qs_dispersion_types.mod subcell_types.mod input_section_types.mod qs_gcp_types.mod base_hooks.mod string_utilities.mod kinds.mod util.mod input_constants.mod cp_log_handling.mod message_passing.mod physcon.mod periodic_table.mod cp_output_handling.mod qs_dftb_utils.mod cp_units.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="\"Thu Oct 7 17:28:45 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 distribution_2d_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod paw_proj_set_types.mod qs_kind_types.mod almo_scf_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_ks_types.mod qs_dftb_types.mod kpoint_types.mod distribution_1d_types.mod ewald_environment_types.mod qs_environment_types.mod external_potential_types.mod qs_dispersion_types.mod subcell_types.mod input_section_types.mod qs_gcp_types.mod base_hooks.mod string_utilities.mod kinds.mod util.mod input_constants.mod cp_log_handling.mod message_passing.mod physcon.mod periodic_table.mod cp_output_handling.mod qs_dftb_utils.mod cp_units.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: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_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 distribution_2d_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod block_p_types.mod kpoint_types.mod distribution_1d_types.mod qs_environment_types.mod hfx_types.mod input_section_types.mod qs_tensors_types.mod base_hooks.mod qs_neighbor_lists.mod libint_2c_3c.mod ai_overlap.mod gamma.mod cp_files.mod kinds.mod input_constants.mod ai_contraction.mod t_c_g0.mod cp_dbcsr_cp2k_link.mod ai_contraction_sphi.mod cp_array_utils.mod hfx_compression_methods.mod orbital_pointers.mod libint_wrapper.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="\"Thu Oct 7 17:28:53 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 distribution_2d_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod block_p_types.mod kpoint_types.mod distribution_1d_types.mod qs_environment_types.mod hfx_types.mod input_section_types.mod qs_tensors_types.mod base_hooks.mod qs_neighbor_lists.mod libint_2c_3c.mod ai_overlap.mod gamma.mod cp_files.mod kinds.mod input_constants.mod ai_contraction.mod t_c_g0.mod cp_dbcsr_cp2k_link.mod ai_contraction_sphi.mod cp_array_utils.mod hfx_compression_methods.mod orbital_pointers.mod libint_wrapper.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 kahan_sum.mod kinds.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="\"Thu Oct 7 17:29:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 kahan_sum.mod kinds.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 scf_control_types.mod xas_env_types.mod qs_mo_types.mod util.mod base_hooks.mod input_constants.mod cp_log_handling.mod kahan_sum.mod fermi_utils.mod kinds.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="\"Thu Oct 7 17:29:02 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 scf_control_types.mod xas_env_types.mod qs_mo_types.mod util.mod base_hooks.mod input_constants.mod cp_log_handling.mod kahan_sum.mod fermi_utils.mod kinds.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_cfm_types.mod cp_para_types.mod cp_fm_types.mod base_hooks.mod cp_cfm_diag.mod kinds.mod cp_blacs_env.mod cp_fm_struct.mod cp_dbcsr_operations.mod cp_fm_diag.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="\"Thu Oct 7 17:29:04 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_cfm_types.mod cp_para_types.mod cp_fm_types.mod base_hooks.mod cp_cfm_diag.mod kinds.mod cp_blacs_env.mod cp_fm_struct.mod cp_dbcsr_operations.mod cp_fm_diag.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 input_constants.mod kinds.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/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="\"Thu Oct 7 17:29:05 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_constants.mod kinds.mod cp_gemm_interface.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_para_types.mod cp_fm_types.mod scf_control_types.mod qs_mo_types.mod base_hooks.mod cp_fm_cholesky.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_log_handling.mod message_passing.mod physcon.mod cp_fm_basic_linalg.mod qs_mo_occupation.mod cp_dbcsr_diag.mod cp_fm_diag.mod 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_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="\"Thu Oct 7 17:29:05 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_para_types.mod cp_fm_types.mod scf_control_types.mod qs_mo_types.mod base_hooks.mod cp_fm_cholesky.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_log_handling.mod message_passing.mod physcon.mod cp_fm_basic_linalg.mod qs_mo_occupation.mod cp_dbcsr_diag.mod cp_fm_diag.mod admm_utils.mod cp_dbcsr_operations.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_cfm_types.mod cp_para_types.mod cp_fm_types.mod base_hooks.mod cp_gemm_interface.mod mathconstants.mod cp_log_handling.mod message_passing.mod cp_fm_basic_linalg.mod kinds.mod cp_cfm_basic_linalg.mod cp_fm_struct.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="\"Thu Oct 7 17:29:07 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_cfm_types.mod cp_para_types.mod cp_fm_types.mod base_hooks.mod cp_gemm_interface.mod mathconstants.mod cp_log_handling.mod message_passing.mod cp_fm_basic_linalg.mod kinds.mod cp_cfm_basic_linalg.mod cp_fm_struct.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 cp_cfm_types.mod cell_types.mod cp_para_types.mod cp_fm_types.mod base_hooks.mod cp_cfm_diag.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_cfm_basic_linalg.mod cp_log_handling.mod message_passing.mod mathconstants.mod cp_fm_basic_linalg.mod matrix_exp.mod cp_fm_diag.mod machine.mod cp_external_control.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="\"Thu Oct 7 17:29:13 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_cfm_types.mod cell_types.mod cp_para_types.mod cp_fm_types.mod base_hooks.mod cp_cfm_diag.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_cfm_basic_linalg.mod cp_log_handling.mod message_passing.mod mathconstants.mod cp_fm_basic_linalg.mod matrix_exp.mod cp_fm_diag.mod machine.mod cp_external_control.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 particle_types.mod basis_set_types.mod cell_types.mod qs_loc_types.mod qs_kind_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod block_p_types.mod distribution_1d_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod cp_fm_struct.mod cp_gemm_interface.mod cp_files.mod kinds.mod qs_localization_methods.mod input_constants.mod cp_log_handling.mod message_passing.mod ai_moments.mod mathconstants.mod cp_array_utils.mod memory_utilities.mod cp_fm_basic_linalg.mod cp_output_handling.mod orbital_pointers.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/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="\"Thu Oct 7 17:29:21 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod cell_types.mod qs_loc_types.mod qs_kind_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod block_p_types.mod distribution_1d_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod cp_fm_struct.mod cp_gemm_interface.mod cp_files.mod kinds.mod qs_localization_methods.mod input_constants.mod cp_log_handling.mod message_passing.mod ai_moments.mod mathconstants.mod cp_array_utils.mod memory_utilities.mod cp_fm_basic_linalg.mod cp_output_handling.mod orbital_pointers.mod cp_fm_diag.mod cp_dbcsr_operations.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 particle_list_types.mod atomic_kind_types.mod pw_types.mod base_hooks.mod cp_output_handling.mod kinds.mod realspace_grid_cube.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="\"Thu Oct 7 17:29:26 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_list_types.mod atomic_kind_types.mod pw_types.mod base_hooks.mod cp_output_handling.mod kinds.mod realspace_grid_cube.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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod qs_loc_types.mod qs_kind_types.mod cp_control_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod string_utilities.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod qs_localization_methods.mod input_constants.mod cp_log_handling.mod qs_collocate_density.mod motion_utils.mod physcon.mod mathconstants.mod qs_matrix_pools.mod memory_utilities.mod cp_output_handling.mod qs_loc_utils.mod cp_realspace_grid_cube.mod machine.mod cp_units.mod particle_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_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="\"Thu Oct 7 17:29:27 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod qs_loc_types.mod qs_kind_types.mod cp_control_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod string_utilities.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod qs_localization_methods.mod input_constants.mod cp_log_handling.mod qs_collocate_density.mod motion_utils.mod physcon.mod mathconstants.mod qs_matrix_pools.mod memory_utilities.mod cp_output_handling.mod qs_loc_utils.mod cp_realspace_grid_cube.mod machine.mod cp_units.mod particle_methods.mod cp_dbcsr_operations.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 distribution_2d_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod qs_loc_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_environment_types.mod hfx_types.mod qs_tensors_types.mod qs_mo_types.mod base_hooks.mod qs_interactions.mod arnoldi_api.mod cp_blacs_env.mod cp_dbcsr_cholesky.mod kinds.mod iterate_matrix.mod util.mod input_constants.mod message_passing.mod qs_tensors.mod input_cp2k_hfx.mod cp_array_utils.mod qs_loc_utils.mod qs_loc_methods.mod cp_dbcsr_diag.mod machine.mod qs_integral_utils.mod particle_methods.mod cp_dbcsr_operations.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="\"Thu Oct 7 17:29:30 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 distribution_2d_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod qs_loc_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_environment_types.mod hfx_types.mod qs_tensors_types.mod qs_mo_types.mod base_hooks.mod qs_interactions.mod arnoldi_api.mod cp_blacs_env.mod cp_dbcsr_cholesky.mod kinds.mod iterate_matrix.mod util.mod input_constants.mod message_passing.mod qs_tensors.mod input_cp2k_hfx.mod cp_array_utils.mod qs_loc_utils.mod qs_loc_methods.mod cp_dbcsr_diag.mod machine.mod qs_integral_utils.mod particle_methods.mod cp_dbcsr_operations.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 qs_kind_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_fm_types.mod base_hooks.mod mathlib.mod machine.mod cp_log_handling.mod message_passing.mod particle_methods.mod kinds.mod orbital_pointers.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="\"Thu Oct 7 17:29:40 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_fm_types.mod base_hooks.mod mathlib.mod machine.mod cp_log_handling.mod message_passing.mod particle_methods.mod kinds.mod orbital_pointers.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_ks_types.mod virial_types.mod block_p_types.mod kpoint_types.mod qs_force_types.mod base_hooks.mod orbital_symbols.mod string_utilities.mod virial_methods.mod ai_overlap.mod kinds.mod ai_contraction.mod cp_dbcsr_cp2k_link.mod orbital_pointers.mod qs_integral_utils.mod particle_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="\"Thu Oct 7 17:29:43 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_ks_types.mod virial_types.mod block_p_types.mod kpoint_types.mod qs_force_types.mod base_hooks.mod orbital_symbols.mod string_utilities.mod virial_methods.mod ai_overlap.mod kinds.mod ai_contraction.mod cp_dbcsr_cp2k_link.mod orbital_pointers.mod qs_integral_utils.mod particle_methods.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="\"Thu Oct 7 17:29:47 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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="\"Thu Oct 7 17:29:47 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_rho_atom_types.mod virial_types.mod qs_oce_types.mod kpoint_types.mod qs_environment_types.mod qs_nl_hash_table_types.mod qs_force_types.mod sap_kind_types.mod base_hooks.mod ao_util.mod virial_methods.mod kinds.mod qs_oce_methods.mod util.mod message_passing.mod cp_array_utils.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="\"Thu Oct 7 17:29:48 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_rho_atom_types.mod virial_types.mod qs_oce_types.mod kpoint_types.mod qs_environment_types.mod qs_nl_hash_table_types.mod qs_force_types.mod sap_kind_types.mod base_hooks.mod ao_util.mod virial_methods.mod kinds.mod qs_oce_methods.mod util.mod message_passing.mod cp_array_utils.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 basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod qs_local_rho_types.mod qs_rho0_types.mod qs_rho_atom_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod orbital_transformation_matrices.mod ao_util.mod qs_harmonics_atom.mod kinds.mod qs_oce_methods.mod cp_log_handling.mod mathconstants.mod memory_utilities.mod qs_grid_atom.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_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="\"Thu Oct 7 17:30:07 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod qs_local_rho_types.mod qs_rho0_types.mod qs_rho_atom_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod orbital_transformation_matrices.mod ao_util.mod qs_harmonics_atom.mod kinds.mod qs_oce_methods.mod cp_log_handling.mod mathconstants.mod memory_utilities.mod qs_grid_atom.mod cp_output_handling.mod orbital_pointers.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 particle_types.mod atomic_kind_types.mod pw_types.mod cell_types.mod pw_env_types.mod admm_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod virial_types.mod qs_environment_types.mod task_list_types.mod qs_force_types.mod base_hooks.mod kinds.mod grid_api.mod input_constants.mod task_list_methods.mod gaussian_gridlevels.mod rs_pw_interface.mod cube_utils.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="\"Thu Oct 7 17:30:10 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_types.mod cell_types.mod pw_env_types.mod admm_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod virial_types.mod qs_environment_types.mod task_list_types.mod qs_force_types.mod base_hooks.mod kinds.mod grid_api.mod input_constants.mod task_list_methods.mod gaussian_gridlevels.mod rs_pw_interface.mod cube_utils.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod virial_types.mod atprop_types.mod qs_environment_types.mod external_potential_types.mod qs_force_types.mod lri_environment_types.mod base_hooks.mod ao_util.mod kinds.mod grid_api.mod message_passing.mod gaussian_gridlevels.mod rs_pw_interface.mod memory_utilities.mod orbital_pointers.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="\"Thu Oct 7 17:30:12 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod virial_types.mod atprop_types.mod qs_environment_types.mod external_potential_types.mod qs_force_types.mod lri_environment_types.mod base_hooks.mod ao_util.mod kinds.mod grid_api.mod message_passing.mod gaussian_gridlevels.mod rs_pw_interface.mod memory_utilities.mod orbital_pointers.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 grid_api.mod base_hooks.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="\"Thu Oct 7 17:30:17 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 grid_api.mod base_hooks.mod qs_integrate_potential_product.mod qs_integrate_potential_single.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod qs_local_rho_types.mod qs_rho0_types.mod cp_para_types.mod qs_rho_atom_types.mod virial_types.mod qs_environment_types.mod qs_force_types.mod base_hooks.mod orbital_transformation_matrices.mod qs_harmonics_atom.mod kinds.mod util.mod grid_api.mod message_passing.mod gaussian_gridlevels.mod pw_methods.mod mathconstants.mod memory_utilities.mod qs_integrate_potential.mod orbital_pointers.mod cube_utils.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="\"Thu Oct 7 17:30:19 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod qs_local_rho_types.mod qs_rho0_types.mod cp_para_types.mod qs_rho_atom_types.mod virial_types.mod qs_environment_types.mod qs_force_types.mod base_hooks.mod orbital_transformation_matrices.mod qs_harmonics_atom.mod kinds.mod util.mod grid_api.mod message_passing.mod gaussian_gridlevels.mod pw_methods.mod mathconstants.mod memory_utilities.mod qs_integrate_potential.mod orbital_pointers.mod cube_utils.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 qs_kind_types.mod cp_control_types.mod atomic_kind_types.mod qs_local_rho_types.mod qs_rho0_types.mod cp_para_types.mod qs_charges_types.mod qs_environment_types.mod qs_rho_atom_types.mod qs_rho0_methods.mod base_hooks.mod cp_log_handling.mod message_passing.mod qs_rho_atom_methods.mod qs_rho0_ggrid.mod kinds.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="\"Thu Oct 7 17:30:23 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod cp_control_types.mod atomic_kind_types.mod qs_local_rho_types.mod qs_rho0_types.mod cp_para_types.mod qs_charges_types.mod qs_environment_types.mod qs_rho_atom_types.mod qs_rho0_methods.mod base_hooks.mod cp_log_handling.mod message_passing.mod qs_rho_atom_methods.mod qs_rho0_ggrid.mod kinds.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 distribution_2d_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_types.mod molecule_types.mod cell_types.mod admm_types.mod paw_proj_set_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_local_rho_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_oce_types.mod qs_rho_types.mod distribution_1d_types.mod qs_environment_types.mod qs_energy_types.mod task_list_types.mod input_section_types.mod qs_force_types.mod qs_mo_types.mod base_hooks.mod qs_neighbor_lists.mod cp_fm_cholesky.mod qs_vxc_atom.mod cp_gemm_interface.mod kinds.mod qs_oce_methods.mod input_constants.mod cp_log_handling.mod task_list_methods.mod qs_rho_atom_methods.mod qs_collocate_density.mod bibliography.mod cp_dbcsr_output.mod qs_vxc.mod cp_dbcsr_cp2k_link.mod qs_overlap.mod cp_fm_basic_linalg.mod cp_output_handling.mod cp_fm_diag.mod qs_ks_atom.mod cp_dbcsr_operations.mod qs_gapw_densities.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="\"Thu Oct 7 17:30:24 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 distribution_2d_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_types.mod molecule_types.mod cell_types.mod admm_types.mod paw_proj_set_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_local_rho_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_oce_types.mod qs_rho_types.mod distribution_1d_types.mod qs_environment_types.mod qs_energy_types.mod task_list_types.mod input_section_types.mod qs_force_types.mod qs_mo_types.mod base_hooks.mod qs_neighbor_lists.mod cp_fm_cholesky.mod qs_vxc_atom.mod cp_gemm_interface.mod kinds.mod qs_oce_methods.mod input_constants.mod cp_log_handling.mod task_list_methods.mod qs_rho_atom_methods.mod qs_collocate_density.mod bibliography.mod cp_dbcsr_output.mod qs_vxc.mod cp_dbcsr_cp2k_link.mod qs_overlap.mod cp_fm_basic_linalg.mod cp_output_handling.mod cp_fm_diag.mod qs_ks_atom.mod cp_dbcsr_operations.mod qs_gapw_densities.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod pw_env_types.mod admm_types.mod qs_kind_types.mod admm_dm_types.mod cp_control_types.mod qs_local_rho_types.mod rt_propagation_types.mod cp_para_types.mod basis_set_container_types.mod qs_ks_types.mod virial_types.mod qs_rho_types.mod qs_environment_types.mod external_potential_types.mod pw_poisson_types.mod hfx_types.mod qs_energy_types.mod input_section_types.mod qs_force_types.mod qs_mo_types.mod base_hooks.mod qs_interactions.mod hfx_energy_potential.mod hfx_pw_methods.mod kinds.mod xc_adiabatic_utils.mod input_constants.mod cp_log_handling.mod qs_rho_atom_methods.mod hfx_derivatives.mod hfx_ri.mod admm_methods.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="\"Thu Oct 7 17:30:31 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod pw_env_types.mod admm_types.mod qs_kind_types.mod admm_dm_types.mod cp_control_types.mod qs_local_rho_types.mod rt_propagation_types.mod cp_para_types.mod basis_set_container_types.mod qs_ks_types.mod virial_types.mod qs_rho_types.mod qs_environment_types.mod external_potential_types.mod pw_poisson_types.mod hfx_types.mod qs_energy_types.mod input_section_types.mod qs_force_types.mod qs_mo_types.mod base_hooks.mod qs_interactions.mod hfx_energy_potential.mod hfx_pw_methods.mod kinds.mod xc_adiabatic_utils.mod input_constants.mod cp_log_handling.mod qs_rho_atom_methods.mod hfx_derivatives.mod hfx_ri.mod admm_methods.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 particle_types.mod pw_types.mod admm_types.mod cp_control_types.mod rt_propagation_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod task_list_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod hfx_admm_utils.mod cp_fm_cholesky.mod cp_gemm_interface.mod kinds.mod input_constants.mod qs_collocate_density.mod mathconstants.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/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="\"Thu Oct 7 17:30:37 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod pw_types.mod admm_types.mod cp_control_types.mod rt_propagation_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod task_list_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod hfx_admm_utils.mod cp_fm_cholesky.mod cp_gemm_interface.mod kinds.mod input_constants.mod qs_collocate_density.mod mathconstants.mod cp_fm_basic_linalg.mod cp_dbcsr_operations.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 qs_density_mixing_types.mod cp_para_types.mod base_hooks.mod mathlib.mod message_passing.mod kinds.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="\"Thu Oct 7 17:30:39 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_density_mixing_types.mod cp_para_types.mod base_hooks.mod mathlib.mod message_passing.mod kinds.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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qs_kind_types.mod qs_neighbor_list_types.mod cp_para_types.mod virial_types.mod atprop_types.mod qs_environment_types.mod qs_dispersion_types.mod input_section_types.mod qs_force_types.mod cp_parser_types.mod base_hooks.mod virial_methods.mod kinds.mod cp_files.mod cp_parser_methods.mod input_constants.mod cp_log_handling.mod message_passing.mod bibliography.mod physcon.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/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="\"Thu Oct 7 17:30:41 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qs_kind_types.mod qs_neighbor_list_types.mod cp_para_types.mod virial_types.mod atprop_types.mod qs_environment_types.mod qs_dispersion_types.mod input_section_types.mod qs_force_types.mod cp_parser_types.mod base_hooks.mod virial_methods.mod kinds.mod cp_files.mod cp_parser_methods.mod input_constants.mod cp_log_handling.mod message_passing.mod bibliography.mod physcon.mod mathconstants.mod memory_utilities.mod cp_output_handling.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 particle_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod virial_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod qs_period_efield_types.mod qs_energy_types.mod qs_force_types.mod base_hooks.mod virial_methods.mod kinds.mod message_passing.mod mathconstants.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="\"Thu Oct 7 17:30:49 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod virial_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod qs_period_efield_types.mod qs_energy_types.mod qs_force_types.mod base_hooks.mod virial_methods.mod kinds.mod message_passing.mod mathconstants.mod 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 particle_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod qs_neighbor_list_types.mod cp_para_types.mod virial_types.mod atprop_types.mod kpoint_types.mod qs_rho_types.mod distribution_1d_types.mod qs_environment_types.mod qs_energy_types.mod qs_force_types.mod sap_kind_types.mod base_hooks.mod virial_methods.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_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="\"Thu Oct 7 17:30:55 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod qs_neighbor_list_types.mod cp_para_types.mod virial_types.mod atprop_types.mod kpoint_types.mod qs_rho_types.mod distribution_1d_types.mod qs_environment_types.mod qs_energy_types.mod qs_force_types.mod sap_kind_types.mod base_hooks.mod virial_methods.mod kinds.mod message_passing.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 cell_types.mod realspace_grid_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="\"Thu Oct 7 17:30:58 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cell_types.mod realspace_grid_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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod realspace_grid_types.mod pw_grid_types.mod atprop_types.mod shell_potential_types.mod ewald_environment_types.mod ewald_pw_types.mod pw_poisson_types.mod base_hooks.mod pme_tools.mod dgs.mod kinds.mod pw_grids.mod bibliography.mod pw_methods.mod mathconstants.mod pw_poisson_methods.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="\"Thu Oct 7 17:30:59 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod realspace_grid_types.mod pw_grid_types.mod atprop_types.mod shell_potential_types.mod ewald_environment_types.mod ewald_pw_types.mod pw_poisson_types.mod base_hooks.mod pme_tools.mod dgs.mod kinds.mod pw_grids.mod bibliography.mod pw_methods.mod mathconstants.mod pw_poisson_methods.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 particle_types.mod pw_pool_types.mod pw_types.mod cell_types.mod realspace_grid_types.mod qs_neighbor_list_types.mod cp_para_types.mod pw_grid_types.mod virial_types.mod atprop_types.mod ewald_environment_types.mod ewald_pw_types.mod pw_poisson_types.mod base_hooks.mod pme_tools.mod virial_methods.mod dgs.mod kinds.mod pw_grids.mod pw_methods.mod mathconstants.mod pw_poisson_methods.mod spme.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="\"Thu Oct 7 17:31:02 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod pw_pool_types.mod pw_types.mod cell_types.mod realspace_grid_types.mod qs_neighbor_list_types.mod cp_para_types.mod pw_grid_types.mod virial_types.mod atprop_types.mod ewald_environment_types.mod ewald_pw_types.mod pw_poisson_types.mod base_hooks.mod pme_tools.mod virial_methods.mod dgs.mod kinds.mod pw_grids.mod pw_methods.mod mathconstants.mod pw_poisson_methods.mod spme.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 particle_types.mod atomic_kind_types.mod cell_types.mod qmmm_types_low.mod cp_control_types.mod cp_para_types.mod virial_types.mod atprop_types.mod qs_rho_types.mod distribution_1d_types.mod ewald_environment_types.mod ewald_pw_types.mod qs_environment_types.mod pw_poisson_types.mod qs_energy_types.mod qs_force_types.mod base_hooks.mod kinds.mod message_passing.mod mathconstants.mod ewald_methods_tb.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="\"Thu Oct 7 17:31:03 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod qmmm_types_low.mod cp_control_types.mod cp_para_types.mod virial_types.mod atprop_types.mod qs_rho_types.mod distribution_1d_types.mod ewald_environment_types.mod ewald_pw_types.mod qs_environment_types.mod pw_poisson_types.mod qs_energy_types.mod qs_force_types.mod base_hooks.mod kinds.mod message_passing.mod mathconstants.mod ewald_methods_tb.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod xtb_types.mod virial_types.mod atprop_types.mod kpoint_types.mod qs_rho_types.mod distribution_1d_types.mod ewald_environment_types.mod ewald_pw_types.mod qs_environment_types.mod pw_poisson_types.mod qs_energy_types.mod qs_force_types.mod sap_kind_types.mod base_hooks.mod virial_methods.mod ai_overlap.mod kinds.mod ai_contraction.mod message_passing.mod qs_dftb3_methods.mod mathconstants.mod orbital_pointers.mod qmmm_tb_coulomb.mod qs_integral_utils.mod ewald_methods_tb.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="\"Thu Oct 7 17:31:06 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod xtb_types.mod virial_types.mod atprop_types.mod kpoint_types.mod qs_rho_types.mod distribution_1d_types.mod ewald_environment_types.mod ewald_pw_types.mod qs_environment_types.mod pw_poisson_types.mod qs_energy_types.mod qs_force_types.mod sap_kind_types.mod base_hooks.mod virial_methods.mod ai_overlap.mod kinds.mod ai_contraction.mod message_passing.mod qs_dftb3_methods.mod mathconstants.mod orbital_pointers.mod qmmm_tb_coulomb.mod qs_integral_utils.mod ewald_methods_tb.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 mathlib.mod cp_fm_basic_linalg.mod arnoldi_api.mod kinds.mod cp_blacs_env.mod cp_fm_struct.mod cp_dbcsr_operations.mod cp_fm_diag.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="\"Thu Oct 7 17:31:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathlib.mod cp_fm_basic_linalg.mod arnoldi_api.mod kinds.mod cp_blacs_env.mod cp_fm_struct.mod cp_dbcsr_operations.mod cp_fm_diag.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 qs_kind_types.mod particle_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="\"Thu Oct 7 17:31:18 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_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 qs_kind_types.mod particle_types.mod cp_control_types.mod cp_para_types.mod atomic_charges.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/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="\"Thu Oct 7 17:31:18 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod cp_control_types.mod cp_para_types.mod atomic_charges.mod base_hooks.mod message_passing.mod kinds.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod xtb_types.mod cp_para_types.mod qs_ks_types.mod virial_types.mod atprop_types.mod block_p_types.mod kpoint_types.mod qs_rho_types.mod ewald_environment_types.mod qs_environment_types.mod qs_scf_types.mod qs_dispersion_types.mod qs_energy_types.mod input_section_types.mod qs_force_types.mod pair_potential_types.mod qs_mo_types.mod base_hooks.mod qs_charge_mixing.mod string_utilities.mod virial_methods.mod ai_overlap.mod cp_blacs_env.mod kinds.mod xtb_parameters.mod cp_log_handling.mod ai_contraction.mod message_passing.mod qs_dispersion_pairpot.mod cp_dbcsr_output.mod cp_dbcsr_cp2k_link.mod qs_overlap.mod efield_tb_methods.mod pair_potential_util.mod cp_output_handling.mod orbital_pointers.mod pair_potential.mod xtb_coulomb.mod qs_condnum.mod mulliken.mod qs_integral_utils.mod cp_dbcsr_operations.mod fparser.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="\"Thu Oct 7 17:31:22 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod xtb_types.mod cp_para_types.mod qs_ks_types.mod virial_types.mod atprop_types.mod block_p_types.mod kpoint_types.mod qs_rho_types.mod ewald_environment_types.mod qs_environment_types.mod qs_scf_types.mod qs_dispersion_types.mod qs_energy_types.mod input_section_types.mod qs_force_types.mod pair_potential_types.mod qs_mo_types.mod base_hooks.mod qs_charge_mixing.mod string_utilities.mod virial_methods.mod ai_overlap.mod cp_blacs_env.mod kinds.mod xtb_parameters.mod cp_log_handling.mod ai_contraction.mod message_passing.mod qs_dispersion_pairpot.mod cp_dbcsr_output.mod cp_dbcsr_cp2k_link.mod qs_overlap.mod efield_tb_methods.mod pair_potential_util.mod cp_output_handling.mod orbital_pointers.mod pair_potential.mod xtb_coulomb.mod qs_condnum.mod mulliken.mod qs_integral_utils.mod cp_dbcsr_operations.mod fparser.mod 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 qs_kind_types.mod particle_types.mod basis_set_types.mod qs_neighbor_list_types.mod block_p_types.mod cell_types.mod cp_para_types.mod qs_environment_types.mod base_hooks.mod mathconstants.mod cp_log_handling.mod ai_moments.mod kinds.mod ai_os_rr.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="\"Thu Oct 7 17:31:33 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod basis_set_types.mod qs_neighbor_list_types.mod block_p_types.mod cell_types.mod cp_para_types.mod qs_environment_types.mod base_hooks.mod mathconstants.mod cp_log_handling.mod ai_moments.mod kinds.mod ai_os_rr.mod orbital_pointers.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 qs_kind_types.mod particle_types.mod atomic_kind_types.mod cell_types.mod cp_para_types.mod fist_environment_types.mod distribution_1d_types.mod qs_environment_types.mod base_hooks.mod input_constants.mod message_passing.mod kinds.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="\"Thu Oct 7 17:31:39 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod atomic_kind_types.mod cell_types.mod cp_para_types.mod fist_environment_types.mod distribution_1d_types.mod qs_environment_types.mod base_hooks.mod input_constants.mod message_passing.mod kinds.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 qs_kind_types.mod particle_types.mod basis_set_types.mod qs_neighbor_list_types.mod block_p_types.mod cell_types.mod sap_kind_types.mod external_potential_types.mod base_hooks.mod ai_moments.mod ai_overlap.mod kinds.mod orbital_pointers.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="\"Thu Oct 7 17:31:41 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod basis_set_types.mod qs_neighbor_list_types.mod block_p_types.mod cell_types.mod sap_kind_types.mod external_potential_types.mod base_hooks.mod ai_moments.mod ai_overlap.mod kinds.mod orbital_pointers.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_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 cp_cfm_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod rt_propagation_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod block_p_types.mod kpoint_types.mod qs_rho_types.mod distribution_1d_types.mod qs_environment_types.mod cp_result_types.mod qs_mo_types.mod base_hooks.mod cp_fm_struct.mod cp_gemm_interface.mod cp_cfm_basic_linalg.mod kinds.mod message_passing.mod ai_moments.mod qs_operators_ao.mod moments_utils.mod physcon.mod cp_dbcsr_cp2k_link.mod commutator_rpnl.mod mathconstants.mod cp_result_methods.mod orbital_pointers.mod ai_angmom.mod particle_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_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="\"Thu Oct 7 17:32:14 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_cfm_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod rt_propagation_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod block_p_types.mod kpoint_types.mod qs_rho_types.mod distribution_1d_types.mod qs_environment_types.mod cp_result_types.mod qs_mo_types.mod base_hooks.mod cp_fm_struct.mod cp_gemm_interface.mod cp_cfm_basic_linalg.mod kinds.mod message_passing.mod ai_moments.mod qs_operators_ao.mod moments_utils.mod physcon.mod cp_dbcsr_cp2k_link.mod commutator_rpnl.mod mathconstants.mod cp_result_methods.mod orbital_pointers.mod ai_angmom.mod particle_methods.mod cp_dbcsr_operations.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 cp_cfm_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod virial_types.mod block_p_types.mod qs_environment_types.mod qs_period_efield_types.mod qs_energy_types.mod qs_force_types.mod qs_mo_types.mod base_hooks.mod virial_methods.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_cfm_basic_linalg.mod message_passing.mod ai_moments.mod mathconstants.mod qs_moments.mod cp_fm_basic_linalg.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_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="\"Thu Oct 7 17:32:27 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_cfm_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod virial_types.mod block_p_types.mod qs_environment_types.mod qs_period_efield_types.mod qs_energy_types.mod qs_force_types.mod qs_mo_types.mod base_hooks.mod virial_methods.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_cfm_basic_linalg.mod message_passing.mod ai_moments.mod mathconstants.mod qs_moments.mod cp_fm_basic_linalg.mod orbital_pointers.mod cp_dbcsr_operations.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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod hirshfeld_types.mod qs_rho_types.mod qs_environment_types.mod base_hooks.mod ao_util.mod kinds.mod grid_api.mod input_constants.mod message_passing.mod periodic_table.mod pw_methods.mod mathconstants.mod cp_units.mod cube_utils.mod atom_kind_orbitals.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="\"Thu Oct 7 17:32:36 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod hirshfeld_types.mod qs_rho_types.mod qs_environment_types.mod base_hooks.mod ao_util.mod kinds.mod grid_api.mod input_constants.mod message_passing.mod periodic_table.mod pw_methods.mod mathconstants.mod cp_units.mod cube_utils.mod atom_kind_orbitals.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_para_types.mod cp_fm_types.mod qs_dftb_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod orbital_symbols.mod qs_mo_methods.mod orbital_transformation_matrices.mod string_utilities.mod kinds.mod cp_files.mod cp_log_handling.mod message_passing.mod kahan_sum.mod physcon.mod cp_output_handling.mod qs_dftb_utils.mod qs_mo_occupation.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_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="\"Thu Oct 7 17:32:40 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_para_types.mod cp_fm_types.mod qs_dftb_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod orbital_symbols.mod qs_mo_methods.mod orbital_transformation_matrices.mod string_utilities.mod kinds.mod cp_files.mod cp_log_handling.mod message_passing.mod kahan_sum.mod physcon.mod cp_output_handling.mod qs_dftb_utils.mod qs_mo_occupation.mod orbital_pointers.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 pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod qmmm_types_low.mod realspace_grid_types.mod cp_control_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod pw_poisson_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod ao_util.mod cp_eri_mme_interface.mod kinds.mod cp_files.mod util.mod input_constants.mod cp_log_handling.mod message_passing.mod qs_collocate_density.mod pw_methods.mod mathconstants.mod memory_utilities.mod eri_mme_integrate.mod cp_output_handling.mod qs_integrate_potential.mod pw_poisson_methods.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="\"Thu Oct 7 17:32:45 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod qmmm_types_low.mod realspace_grid_types.mod cp_control_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod pw_poisson_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod ao_util.mod cp_eri_mme_interface.mod kinds.mod cp_files.mod util.mod input_constants.mod cp_log_handling.mod message_passing.mod qs_collocate_density.mod pw_methods.mod mathconstants.mod memory_utilities.mod eri_mme_integrate.mod cp_output_handling.mod qs_integrate_potential.mod pw_poisson_methods.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 particle_types.mod atomic_kind_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_cdft_opt_types.mod cp_para_types.mod qs_cdft_types.mod qs_rho_types.mod ps_implicit_types.mod qs_charges_types.mod qs_environment_types.mod qs_scf_types.mod pw_poisson_types.mod scf_control_types.mod qs_energy_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod kinds.mod input_constants.mod cp_log_handling.mod kahan_sum.mod qs_mo_io.mod cp_dbcsr_output.mod physcon.mod qmmm_image_charge.mod cp_output_handling.mod machine.mod cp_units.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="\"Thu Oct 7 17:32:48 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_cdft_opt_types.mod cp_para_types.mod qs_cdft_types.mod qs_rho_types.mod ps_implicit_types.mod qs_charges_types.mod qs_environment_types.mod qs_scf_types.mod pw_poisson_types.mod scf_control_types.mod qs_energy_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod kinds.mod input_constants.mod cp_log_handling.mod kahan_sum.mod qs_mo_io.mod cp_dbcsr_output.mod physcon.mod qmmm_image_charge.mod cp_output_handling.mod machine.mod cp_units.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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod hirshfeld_types.mod qs_cdft_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod outer_scf_control_types.mod base_hooks.mod ao_util.mod hirshfeld_methods.mod kinds.mod qs_scf_output.mod grid_api.mod input_constants.mod cp_log_handling.mod bibliography.mod memory_utilities.mod cp_output_handling.mod cp_realspace_grid_cube.mod cp_units.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="\"Thu Oct 7 17:32:52 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod hirshfeld_types.mod qs_cdft_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod outer_scf_control_types.mod base_hooks.mod ao_util.mod hirshfeld_methods.mod kinds.mod qs_scf_output.mod grid_api.mod input_constants.mod cp_log_handling.mod bibliography.mod memory_utilities.mod cp_output_handling.mod cp_realspace_grid_cube.mod cp_units.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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod qs_rho0_types.mod cp_para_types.mod hirshfeld_types.mod qs_cdft_types.mod qs_rho_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod qs_force_types.mod base_hooks.mod ao_util.mod kinds.mod grid_api.mod input_constants.mod cp_log_handling.mod message_passing.mod kahan_sum.mod pw_methods.mod cp_output_handling.mod cp_realspace_grid_cube.mod qs_cdft_utils.mod cube_utils.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="\"Thu Oct 7 17:32:57 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod qs_rho0_types.mod cp_para_types.mod hirshfeld_types.mod qs_cdft_types.mod qs_rho_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod qs_force_types.mod base_hooks.mod ao_util.mod kinds.mod grid_api.mod input_constants.mod cp_log_handling.mod message_passing.mod kahan_sum.mod pw_methods.mod cp_output_handling.mod cp_realspace_grid_cube.mod qs_cdft_utils.mod cube_utils.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_control_types.mod cp_para_types.mod cp_fm_types.mod qs_mo_types.mod base_hooks.mod cp_gemm_interface.mod input_constants.mod message_passing.mod kinds.mod cp_blacs_env.mod cp_fm_struct.mod cp_dbcsr_operations.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="\"Thu Oct 7 17:33:04 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_control_types.mod cp_para_types.mod cp_fm_types.mod qs_mo_types.mod base_hooks.mod cp_gemm_interface.mod input_constants.mod message_passing.mod kinds.mod cp_blacs_env.mod cp_fm_struct.mod cp_dbcsr_operations.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 pw_pool_types.mod pw_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_cdft_types.mod qs_rho_types.mod qs_environment_types.mod qs_energy_types.mod qs_mo_types.mod base_hooks.mod kinds.mod qs_cdft_methods.mod input_constants.mod pw_methods.mod s_square_methods.mod mulliken.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="\"Thu Oct 7 17:33:05 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_pool_types.mod pw_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_cdft_types.mod qs_rho_types.mod qs_environment_types.mod qs_energy_types.mod qs_mo_types.mod base_hooks.mod kinds.mod qs_cdft_methods.mod input_constants.mod pw_methods.mod s_square_methods.mod mulliken.mod cp_dbcsr_operations.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 orbital_pointers.mod mathconstants.mod kinds.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="\"Thu Oct 7 17:33:07 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 orbital_pointers.mod mathconstants.mod kinds.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 kinds.mod base_hooks.mod mathconstants.mod gamma.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="\"Thu Oct 7 17:33:11 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 kinds.mod base_hooks.mod mathconstants.mod gamma.mod 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="\"Thu Oct 7 17:33:15 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 construct_shg.mod s_contract_shg.mod constants_operator.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/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="\"Thu Oct 7 17:33:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 construct_shg.mod s_contract_shg.mod constants_operator.mod kinds.mod orbital_pointers.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:541: update target 'ai_overlap3.mod' due to: ai_overlap3.o 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 orbital_pointers.mod kinds.mod ai_overlap.mod ai_overlap_aabb.mod ai_overlap3.mod ai_overlap_debug.mod ai_overlap3_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="\"Thu Oct 7 17:33:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 orbital_pointers.mod kinds.mod ai_overlap.mod ai_overlap_aabb.mod ai_overlap3.mod ai_overlap_debug.mod ai_overlap3_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 ai_derivatives.mod ai_contraction_sphi.mod debug_os_integrals.mod ai_operator_ra2m.mod kinds.mod ai_overlap.mod constants_operator.mod ai_overlap_aabb.mod orbital_pointers.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="\"Thu Oct 7 17:33:26 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 ai_derivatives.mod ai_contraction_sphi.mod debug_os_integrals.mod ai_operator_ra2m.mod kinds.mod ai_overlap.mod constants_operator.mod ai_overlap_aabb.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 generic_shg_integrals.mod kinds.mod generic_os_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="\"Thu Oct 7 17:33:32 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 generic_shg_integrals.mod kinds.mod generic_os_integrals.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 virial_types.mod basis_set_types.mod lri_environment_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod kpoint_types.mod qs_o3c_types.mod qs_force_types.mod qs_environment_types.mod qs_ks_types.mod base_hooks.mod virial_methods.mod lri_integrals.mod kinds.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="\"Thu Oct 7 17:33:35 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 virial_types.mod basis_set_types.mod lri_environment_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod kpoint_types.mod qs_o3c_types.mod qs_force_types.mod qs_environment_types.mod qs_ks_types.mod base_hooks.mod virial_methods.mod lri_integrals.mod kinds.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="\"Thu Oct 7 17:33:42 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod virial_types.mod basis_set_types.mod lri_environment_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod qs_force_types.mod external_potential_types.mod base_hooks.mod ai_overlap_ppl.mod virial_methods.mod kinds.mod orbital_pointers.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="\"Thu Oct 7 17:33:43 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod virial_types.mod basis_set_types.mod lri_environment_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod qs_force_types.mod external_potential_types.mod base_hooks.mod ai_overlap_ppl.mod virial_methods.mod kinds.mod orbital_pointers.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod virial_types.mod qs_rho_types.mod qs_environment_types.mod input_section_types.mod qs_force_types.mod lri_environment_types.mod base_hooks.mod kinds.mod generic_os_integrals.mod input_constants.mod cp_log_handling.mod lri_compression.mod message_passing.mod qs_collocate_density.mod lri_integrals.mod cp_output_handling.mod mathlib.mod core_ppl.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="\"Thu Oct 7 17:33:51 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod virial_types.mod qs_rho_types.mod qs_environment_types.mod input_section_types.mod qs_force_types.mod lri_environment_types.mod base_hooks.mod kinds.mod generic_os_integrals.mod input_constants.mod cp_log_handling.mod lri_compression.mod message_passing.mod qs_collocate_density.mod lri_integrals.mod cp_output_handling.mod mathlib.mod core_ppl.mod 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 ai_contraction_sphi.mod kinds.mod ai_overlap3.mod orbital_pointers.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="\"Thu Oct 7 17:33:57 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 ai_contraction_sphi.mod kinds.mod ai_overlap3.mod orbital_pointers.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 atomic_kind_types.mod pw_types.mod cp_control_types.mod cp_para_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod qs_o3c_types.mod lri_environment_types.mod base_hooks.mod arnoldi_api.mod cp_blacs_env.mod kinds.mod iterate_matrix.mod util.mod message_passing.mod qs_collocate_density.mod cp_dbcsr_cp2k_link.mod qs_overlap.mod qs_o3c_methods.mod cp_dbcsr_diag.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="\"Thu Oct 7 17:34:02 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 atomic_kind_types.mod pw_types.mod cp_control_types.mod cp_para_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod qs_o3c_types.mod lri_environment_types.mod base_hooks.mod arnoldi_api.mod cp_blacs_env.mod kinds.mod iterate_matrix.mod util.mod message_passing.mod qs_collocate_density.mod cp_dbcsr_cp2k_link.mod qs_overlap.mod qs_o3c_methods.mod cp_dbcsr_diag.mod cp_dbcsr_operations.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 lri_environment_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod qs_o3c_types.mod base_hooks.mod lri_compression.mod qs_o3c_methods.mod kinds.mod ri_environment_methods.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="\"Thu Oct 7 17:34:06 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 lri_environment_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod qs_o3c_types.mod base_hooks.mod lri_compression.mod qs_o3c_methods.mod kinds.mod ri_environment_methods.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 particle_types.mod cp_control_types.mod atomic_kind_types.mod pw_types.mod cell_types.mod cp_para_types.mod input_section_types.mod qs_force_types.mod qs_environment_types.mod base_hooks.mod input_constants.mod mathconstants.mod message_passing.mod pw_spline_utils.mod kinds.mod spherical_harmonics.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="\"Thu Oct 7 17:34:09 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod cp_control_types.mod atomic_kind_types.mod pw_types.mod cell_types.mod cp_para_types.mod input_section_types.mod qs_force_types.mod qs_environment_types.mod base_hooks.mod input_constants.mod mathconstants.mod message_passing.mod pw_spline_utils.mod kinds.mod spherical_harmonics.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 particle_types.mod cp_ddapc_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod qs_rho_types.mod qs_charges_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod pw_methods.mod mathconstants.mod cp_ddapc_methods.mod cp_output_handling.mod atomic_charges.mod cp_ddapc_forces.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="\"Thu Oct 7 17:34:12 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod cp_ddapc_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod qs_rho_types.mod qs_charges_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod pw_methods.mod mathconstants.mod cp_ddapc_methods.mod cp_output_handling.mod atomic_charges.mod cp_ddapc_forces.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 particle_types.mod pw_pool_types.mod pw_types.mod cell_types.mod cp_control_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod bibliography.mod pw_methods.mod cp_output_handling.mod qs_integrate_potential.mod cp_ddapc_forces.mod cp_ddapc_util.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="\"Thu Oct 7 17:34:18 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod pw_pool_types.mod pw_types.mod cell_types.mod cp_control_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod bibliography.mod pw_methods.mod cp_output_handling.mod qs_integrate_potential.mod cp_ddapc_forces.mod cp_ddapc_util.mod 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 cp_control_types.mod pw_pool_types.mod pw_types.mod qs_ks_qmmm_types.mod input_section_types.mod pw_env_types.mod qmmm_types_low.mod qs_environment_types.mod base_hooks.mod pw_methods.mod input_constants.mod cp_log_handling.mod d3_poly.mod cp_output_handling.mod cube_utils.mod kinds.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="\"Thu Oct 7 17:34:20 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_control_types.mod pw_pool_types.mod pw_types.mod qs_ks_qmmm_types.mod input_section_types.mod pw_env_types.mod qmmm_types_low.mod qs_environment_types.mod base_hooks.mod pw_methods.mod input_constants.mod cp_log_handling.mod d3_poly.mod cp_output_handling.mod cube_utils.mod kinds.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 atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod admm_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod pw_grid_types.mod cp_fm_types.mod qs_ks_types.mod qs_mo_types.mod qs_cdft_types.mod virial_types.mod kpoint_types.mod qs_rho_types.mod ps_implicit_types.mod qs_charges_types.mod qs_environment_types.mod pw_poisson_types.mod qs_energy_types.mod task_list_types.mod input_section_types.mod qs_force_types.mod lri_environment_types.mod base_hooks.mod lri_forces.mod cp_fm_struct.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod kahan_sum.mod qs_collocate_density.mod pw_methods.mod cp_output_handling.mod qs_integrate_potential.mod lri_environment_methods.mod pw_poisson_methods.mod lri_ks_methods.mod xc.mod cp_ddapc.mod cp_dbcsr_operations.mod qs_ks_qmmm_methods.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="\"Thu Oct 7 17:34:21 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod admm_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod pw_grid_types.mod cp_fm_types.mod qs_ks_types.mod qs_mo_types.mod qs_cdft_types.mod virial_types.mod kpoint_types.mod qs_rho_types.mod ps_implicit_types.mod qs_charges_types.mod qs_environment_types.mod pw_poisson_types.mod qs_energy_types.mod task_list_types.mod input_section_types.mod qs_force_types.mod lri_environment_types.mod base_hooks.mod lri_forces.mod cp_fm_struct.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod kahan_sum.mod qs_collocate_density.mod pw_methods.mod cp_output_handling.mod qs_integrate_potential.mod lri_environment_methods.mod pw_poisson_methods.mod lri_ks_methods.mod xc.mod cp_ddapc.mod cp_dbcsr_operations.mod qs_ks_qmmm_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 particle_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod orbital_symbols.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod bibliography.mod cp_dbcsr_output.mod physcon.mod cp_fm_basic_linalg.mod cp_output_handling.mod mathlib.mod particle_methods.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="\"Thu Oct 7 17:34:31 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod orbital_symbols.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod bibliography.mod cp_dbcsr_output.mod physcon.mod cp_fm_basic_linalg.mod cp_output_handling.mod mathlib.mod particle_methods.mod cp_dbcsr_operations.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 atomic_kind_types.mod pw_pool_types.mod pw_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_local_rho_types.mod cp_para_types.mod qs_ks_types.mod qs_rho_atom_types.mod qs_oce_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod task_list_types.mod lri_environment_types.mod base_hooks.mod kinds.mod cp_log_handling.mod qs_rho_atom_methods.mod qs_collocate_density.mod ri_environment_methods.mod cp_dbcsr_cp2k_link.mod pw_methods.mod lri_environment_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_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="\"Thu Oct 7 17:34:40 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 atomic_kind_types.mod pw_pool_types.mod pw_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_local_rho_types.mod cp_para_types.mod qs_ks_types.mod qs_rho_atom_types.mod qs_oce_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod task_list_types.mod lri_environment_types.mod base_hooks.mod kinds.mod cp_log_handling.mod qs_rho_atom_methods.mod qs_collocate_density.mod ri_environment_methods.mod cp_dbcsr_cp2k_link.mod pw_methods.mod lri_environment_methods.mod cp_dbcsr_operations.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 xc_rho_set_types.mod xc_derivative_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod pw_env_types.mod kg_environment_types.mod cp_control_types.mod cp_para_types.mod qs_ks_types.mod virial_types.mod qs_rho_types.mod qs_environment_types.mod input_section_types.mod lri_environment_types.mod base_hooks.mod lri_forces.mod kinds.mod input_constants.mod message_passing.mod qs_vxc.mod pw_methods.mod xc_derivatives.mod qs_integrate_potential.mod lri_environment_methods.mod lri_ks_methods.mod qs_rho_methods.mod xc.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="\"Thu Oct 7 17:34:46 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 xc_rho_set_types.mod xc_derivative_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod pw_env_types.mod kg_environment_types.mod cp_control_types.mod cp_para_types.mod qs_ks_types.mod virial_types.mod qs_rho_types.mod qs_environment_types.mod input_section_types.mod lri_environment_types.mod base_hooks.mod lri_forces.mod kinds.mod input_constants.mod message_passing.mod qs_vxc.mod pw_methods.mod xc_derivatives.mod qs_integrate_potential.mod lri_environment_methods.mod lri_ks_methods.mod qs_rho_methods.mod xc.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 basis_set_types.mod atomic_kind_types.mod cell_types.mod pw_env_types.mod qs_kind_types.mod hartree_local_types.mod cp_control_types.mod qs_local_rho_types.mod qs_rho0_types.mod cp_para_types.mod qs_rho_atom_types.mod atprop_types.mod qs_charges_types.mod qs_environment_types.mod pw_poisson_types.mod base_hooks.mod qs_harmonics_atom.mod kinds.mod util.mod message_passing.mod mathconstants.mod qs_grid_atom.mod orbital_pointers.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="\"Thu Oct 7 17:34:50 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 basis_set_types.mod atomic_kind_types.mod cell_types.mod pw_env_types.mod qs_kind_types.mod hartree_local_types.mod cp_control_types.mod qs_local_rho_types.mod qs_rho0_types.mod cp_para_types.mod qs_rho_atom_types.mod atprop_types.mod qs_charges_types.mod qs_environment_types.mod pw_poisson_types.mod base_hooks.mod qs_harmonics_atom.mod kinds.mod util.mod message_passing.mod mathconstants.mod qs_grid_atom.mod orbital_pointers.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 pw_pool_types.mod pw_types.mod pw_env_types.mod realspace_grid_types.mod cp_control_types.mod cp_para_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod cp_subsys_types.mod pw_poisson_types.mod particle_list_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod kahan_sum.mod pw_methods.mod mathconstants.mod rs_methods.mod cp_output_handling.mod cp_realspace_grid_cube.mod pw_poisson_methods.mod cp_units.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="\"Thu Oct 7 17:34:56 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_pool_types.mod pw_types.mod pw_env_types.mod realspace_grid_types.mod cp_control_types.mod cp_para_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod cp_subsys_types.mod pw_poisson_types.mod particle_list_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod kahan_sum.mod pw_methods.mod mathconstants.mod rs_methods.mod cp_output_handling.mod cp_realspace_grid_cube.mod pw_poisson_methods.mod cp_units.mod cp_realspace_grid_init.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 input_constants.mod semi_empirical_int_arrays.mod kinds.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="\"Thu Oct 7 17:34:59 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_constants.mod semi_empirical_int_arrays.mod kinds.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 input_constants.mod semi_empirical_int_arrays.mod kinds.mod semi_empirical_int3_utils.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="\"Thu Oct 7 17:35:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_constants.mod semi_empirical_int_arrays.mod kinds.mod semi_empirical_int3_utils.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 multipole_types.mod semi_empirical_types.mod taper_types.mod base_hooks.mod semi_empirical_int_utils.mod input_constants.mod semi_empirical_int_arrays.mod kinds.mod physcon.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="\"Thu Oct 7 17:35:05 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 multipole_types.mod semi_empirical_types.mod taper_types.mod base_hooks.mod semi_empirical_int_utils.mod input_constants.mod semi_empirical_int_arrays.mod kinds.mod physcon.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_debug.f90 /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_args.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 multipole_types.mod semi_empirical_types.mod taper_types.mod semi_empirical_int_num.mod base_hooks.mod semi_empirical_int_utils.mod input_constants.mod semi_empirical_int_arrays.mod kinds.mod physcon.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="\"Thu Oct 7 17:35:06 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_debug.f90 /build/cp2k-Q381vr/cp2k-8.1/src/semi_empirical_int_args.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 multipole_types.mod semi_empirical_types.mod taper_types.mod semi_empirical_int_num.mod base_hooks.mod semi_empirical_int_utils.mod input_constants.mod semi_empirical_int_arrays.mod kinds.mod physcon.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 dg_types.mod pw_pool_types.mod semi_empirical_mpole_types.mod pw_grid_types.mod multipole_types.mod semi_empirical_types.mod dg_rho0_types.mod base_hooks.mod mathconstants.mod semi_empirical_int_arrays.mod kinds.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="\"Thu Oct 7 17:35:10 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 dg_types.mod pw_pool_types.mod semi_empirical_mpole_types.mod pw_grid_types.mod multipole_types.mod semi_empirical_types.mod dg_rho0_types.mod base_hooks.mod mathconstants.mod semi_empirical_int_arrays.mod kinds.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_store_int_types.mod semi_empirical_types.mod semi_empirical_int_num.mod base_hooks.mod input_constants.mod memory_utilities.mod semi_empirical_int_ana.mod kinds.mod semi_empirical_int_gks.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_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="\"Thu Oct 7 17:35:14 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_store_int_types.mod semi_empirical_types.mod semi_empirical_int_num.mod base_hooks.mod input_constants.mod memory_utilities.mod semi_empirical_int_ana.mod kinds.mod semi_empirical_int_gks.mod hfx_compression_methods.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_store_int_types.mod semi_empirical_types.mod base_hooks.mod semi_empirical_integrals.mod semi_empirical_int_arrays.mod kinds.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="\"Thu Oct 7 17:35:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_store_int_types.mod semi_empirical_types.mod base_hooks.mod semi_empirical_integrals.mod semi_empirical_int_arrays.mod kinds.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 particle_types.mod atomic_kind_types.mod cell_types.mod multipole_types.mod semi_empirical_types.mod qs_kind_types.mod semi_empirical_store_int_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod qs_force_types.mod base_hooks.mod semi_empirical_utils.mod virial_methods.mod kinds.mod input_constants.mod se_fock_matrix_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_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="\"Thu Oct 7 17:35:20 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod multipole_types.mod semi_empirical_types.mod qs_kind_types.mod semi_empirical_store_int_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod qs_force_types.mod base_hooks.mod semi_empirical_utils.mod virial_methods.mod kinds.mod input_constants.mod se_fock_matrix_integrals.mod semi_empirical_int_arrays.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 particle_types.mod atomic_kind_types.mod cell_types.mod cp_para_types.mod input_section_types.mod distribution_1d_types.mod fist_nonbond_env_types.mod pair_potential_types.mod fist_neighbor_list_types.mod exclusion_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod fist_neighbor_lists.mod cp_output_handling.mod kinds.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="\"Thu Oct 7 17:35:23 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod cp_para_types.mod input_section_types.mod distribution_1d_types.mod fist_nonbond_env_types.mod pair_potential_types.mod fist_neighbor_list_types.mod exclusion_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod fist_neighbor_lists.mod cp_output_handling.mod kinds.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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod structure_factor_types.mod cell_types.mod fist_neighbor_list_types.mod pw_grid_types.mod parallel_rng_types.mod distribution_1d_types.mod ewald_environment_types.mod ewald_pw_types.mod fist_nonbond_env_types.mod damping_dipole_types.mod dg_rho0_types.mod dg_types.mod input_section_types.mod base_hooks.mod structure_factors.mod kinds.mod fist_neighbor_list_control.mod cp_log_handling.mod message_passing.mod bibliography.mod mathconstants.mod mathlib.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="\"Thu Oct 7 17:35:23 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod structure_factor_types.mod cell_types.mod fist_neighbor_list_types.mod pw_grid_types.mod parallel_rng_types.mod distribution_1d_types.mod ewald_environment_types.mod ewald_pw_types.mod fist_nonbond_env_types.mod damping_dipole_types.mod dg_rho0_types.mod dg_types.mod input_section_types.mod base_hooks.mod structure_factors.mod kinds.mod fist_neighbor_list_control.mod cp_log_handling.mod message_passing.mod bibliography.mod mathconstants.mod mathlib.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 particle_types.mod atomic_kind_types.mod semi_empirical_mpole_types.mod cell_types.mod multipole_types.mod semi_empirical_types.mod qs_kind_types.mod semi_empirical_store_int_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod virial_types.mod atprop_types.mod distribution_1d_types.mod ewald_environment_types.mod ewald_pw_types.mod fist_nonbond_env_types.mod qs_environment_types.mod pw_poisson_types.mod qs_energy_types.mod input_section_types.mod qs_force_types.mod base_hooks.mod semi_empirical_utils.mod virial_methods.mod kinds.mod fist_neighbor_list_control.mod input_constants.mod cp_log_handling.mod se_fock_matrix_integrals.mod message_passing.mod semi_empirical_int_arrays.mod semi_empirical_mpole_methods.mod cp_output_handling.mod ewalds_multipole.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="\"Thu Oct 7 17:35:39 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod semi_empirical_mpole_types.mod cell_types.mod multipole_types.mod semi_empirical_types.mod qs_kind_types.mod semi_empirical_store_int_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod virial_types.mod atprop_types.mod distribution_1d_types.mod ewald_environment_types.mod ewald_pw_types.mod fist_nonbond_env_types.mod qs_environment_types.mod pw_poisson_types.mod qs_energy_types.mod input_section_types.mod qs_force_types.mod base_hooks.mod semi_empirical_utils.mod virial_methods.mod kinds.mod fist_neighbor_list_control.mod input_constants.mod cp_log_handling.mod se_fock_matrix_integrals.mod message_passing.mod semi_empirical_int_arrays.mod semi_empirical_mpole_methods.mod cp_output_handling.mod ewalds_multipole.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 semi_empirical_store_int_types.mod qs_energy_types.mod qs_environment_types.mod base_hooks.mod se_fock_matrix_coulomb.mod kinds.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="\"Thu Oct 7 17:35:44 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 semi_empirical_store_int_types.mod qs_energy_types.mod qs_environment_types.mod base_hooks.mod se_fock_matrix_coulomb.mod kinds.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 particle_types.mod atomic_kind_types.mod semi_empirical_store_int_types.mod cp_control_types.mod cp_para_types.mod qs_ks_types.mod atprop_types.mod qs_rho_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod se_fock_matrix_exchange.mod kinds.mod input_constants.mod cp_log_handling.mod se_fock_matrix_coulomb.mod se_fock_matrix_dbg.mod cp_output_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="\"Thu Oct 7 17:35:46 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod semi_empirical_store_int_types.mod cp_control_types.mod cp_para_types.mod qs_ks_types.mod atprop_types.mod qs_rho_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod se_fock_matrix_exchange.mod kinds.mod input_constants.mod cp_log_handling.mod se_fock_matrix_coulomb.mod se_fock_matrix_dbg.mod cp_output_handling.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 admm_dm_types.mod cp_control_types.mod pw_types.mod task_list_types.mod qs_rho_types.mod qs_ks_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod qs_collocate_density.mod kinds.mod cp_dbcsr_operations.mod iterate_matrix.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="\"Thu Oct 7 17:35:48 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 admm_dm_types.mod cp_control_types.mod pw_types.mod task_list_types.mod qs_rho_types.mod qs_ks_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod qs_collocate_density.mod kinds.mod cp_dbcsr_operations.mod iterate_matrix.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 particle_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_dftb_types.mod virial_types.mod atprop_types.mod kpoint_types.mod qs_rho_types.mod distribution_1d_types.mod ewald_environment_types.mod ewald_pw_types.mod qs_environment_types.mod pw_poisson_types.mod qs_energy_types.mod qs_force_types.mod sap_kind_types.mod base_hooks.mod virial_methods.mod kinds.mod message_passing.mod qs_dftb3_methods.mod mathconstants.mod qs_dftb_utils.mod qmmm_tb_coulomb.mod ewald_methods_tb.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="\"Thu Oct 7 17:35:50 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_dftb_types.mod virial_types.mod atprop_types.mod kpoint_types.mod qs_rho_types.mod distribution_1d_types.mod ewald_environment_types.mod ewald_pw_types.mod qs_environment_types.mod pw_poisson_types.mod qs_energy_types.mod qs_force_types.mod sap_kind_types.mod base_hooks.mod virial_methods.mod kinds.mod message_passing.mod qs_dftb3_methods.mod mathconstants.mod qs_dftb_utils.mod qmmm_tb_coulomb.mod ewald_methods_tb.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 particle_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_ks_types.mod qs_dftb_types.mod virial_types.mod atprop_types.mod block_p_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod qs_force_types.mod qs_mo_types.mod base_hooks.mod virial_methods.mod kinds.mod cp_log_handling.mod message_passing.mod cp_dbcsr_output.mod cp_dbcsr_cp2k_link.mod efield_tb_methods.mod cp_output_handling.mod qs_dftb_utils.mod mulliken.mod particle_methods.mod qs_dftb_coulomb.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="\"Thu Oct 7 17:35:56 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_ks_types.mod qs_dftb_types.mod virial_types.mod atprop_types.mod block_p_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod qs_force_types.mod qs_mo_types.mod base_hooks.mod virial_methods.mod kinds.mod cp_log_handling.mod message_passing.mod cp_dbcsr_output.mod cp_dbcsr_cp2k_link.mod efield_tb_methods.mod cp_output_handling.mod qs_dftb_utils.mod mulliken.mod particle_methods.mod qs_dftb_coulomb.mod cp_dbcsr_operations.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_rho_types.mod qs_environment_types.mod qs_period_efield_types.mod qs_energy_types.mod qs_force_types.mod base_hooks.mod kinds.mod message_passing.mod ai_moments.mod qs_moments.mod orbital_pointers.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="\"Thu Oct 7 17:36:02 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_rho_types.mod qs_environment_types.mod qs_period_efield_types.mod qs_energy_types.mod qs_force_types.mod base_hooks.mod kinds.mod message_passing.mod ai_moments.mod qs_moments.mod orbital_pointers.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_kind_types.mod particle_types.mod cp_control_types.mod atomic_kind_types.mod pw_types.mod qs_energy_types.mod cell_types.mod qs_rho_types.mod cp_para_types.mod qs_force_types.mod qs_environment_types.mod base_hooks.mod input_constants.mod mathconstants.mod message_passing.mod kahan_sum.mod kinds.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="\"Thu Oct 7 17:36:05 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_kind_types.mod particle_types.mod cp_control_types.mod atomic_kind_types.mod pw_types.mod qs_energy_types.mod cell_types.mod qs_rho_types.mod cp_para_types.mod qs_force_types.mod qs_environment_types.mod base_hooks.mod input_constants.mod mathconstants.mod message_passing.mod kahan_sum.mod kinds.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_kind_types.mod particle_types.mod virial_types.mod atprop_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod qs_energy_types.mod cp_para_types.mod distribution_1d_types.mod qs_environment_types.mod qs_force_types.mod base_hooks.mod mathconstants.mod message_passing.mod virial_methods.mod kinds.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="\"Thu Oct 7 17:36:07 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_kind_types.mod particle_types.mod virial_types.mod atprop_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod qs_energy_types.mod cp_para_types.mod distribution_1d_types.mod qs_environment_types.mod qs_force_types.mod base_hooks.mod mathconstants.mod message_passing.mod virial_methods.mod kinds.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 pw_pool_types.mod pw_types.mod cell_types.mod admm_types.mod pw_env_types.mod hartree_local_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_local_rho_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_mo_types.mod qs_cdft_types.mod virial_types.mod qs_rho_types.mod qs_charges_types.mod qs_environment_types.mod pw_poisson_types.mod qs_energy_types.mod input_section_types.mod lri_environment_types.mod surface_dipole.mod rtp_admm_methods.mod hfx_admm_utils.mod base_hooks.mod xtb_matrices.mod qs_vxc_atom.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod qs_efield_berry.mod qs_ks_apply_restraints.mod cp_dbcsr_operations.mod input_constants.mod cp_log_handling.mod message_passing.mod qs_ks_utils.mod dft_plus_u.mod kg_correction.mod qs_rho0_ggrid.mod qs_vxc.mod cp_dbcsr_cp2k_link.mod hartree_local_methods.mod pw_methods.mod qmmm_image_charge.mod admm_methods.mod qs_ks_qmmm_methods.mod qs_sccs.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_integrate_potential.mod lri_environment_methods.mod se_fock_matrix.mod mathlib.mod pw_poisson_methods.mod admm_dm_methods.mod qs_dftb_matrices.mod qs_efield_local.mod qs_ks_atom.mod cp_ddapc.mod efield_utils.mod qs_gapw_densities.mod qs_core_energies.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="\"Thu Oct 7 17:36:09 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_pool_types.mod pw_types.mod cell_types.mod admm_types.mod pw_env_types.mod hartree_local_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_local_rho_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_mo_types.mod qs_cdft_types.mod virial_types.mod qs_rho_types.mod qs_charges_types.mod qs_environment_types.mod pw_poisson_types.mod qs_energy_types.mod input_section_types.mod lri_environment_types.mod surface_dipole.mod rtp_admm_methods.mod hfx_admm_utils.mod base_hooks.mod xtb_matrices.mod qs_vxc_atom.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod qs_efield_berry.mod qs_ks_apply_restraints.mod cp_dbcsr_operations.mod input_constants.mod cp_log_handling.mod message_passing.mod qs_ks_utils.mod dft_plus_u.mod kg_correction.mod qs_rho0_ggrid.mod qs_vxc.mod cp_dbcsr_cp2k_link.mod hartree_local_methods.mod pw_methods.mod qmmm_image_charge.mod admm_methods.mod qs_ks_qmmm_methods.mod qs_sccs.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_integrate_potential.mod lri_environment_methods.mod se_fock_matrix.mod mathlib.mod pw_poisson_methods.mod admm_dm_methods.mod qs_dftb_matrices.mod qs_efield_local.mod qs_ks_atom.mod cp_ddapc.mod efield_utils.mod qs_gapw_densities.mod qs_core_energies.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="\"Thu Oct 7 17:36:18 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod pao_types.mod cell_types.mod util.mod base_hooks.mod mathlib.mod mathconstants.mod pao_input.mod kinds.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="\"Thu Oct 7 17:36:19 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod pao_types.mod cell_types.mod util.mod base_hooks.mod mathlib.mod mathconstants.mod pao_input.mod kinds.mod pao_potentials.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 parallel_rng_types.mod 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_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="\"Thu Oct 7 17:36:23 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 parallel_rng_types.mod pao_types.mod base_hooks.mod kinds.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 qs_kind_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod pao_types.mod cell_types.mod cp_para_types.mod qs_environment_types.mod base_hooks.mod machine.mod message_passing.mod pao_ml_gaussprocess.mod pao_ml_descriptor.mod pao_input.mod pao_io.mod kinds.mod pao_ml_neuralnet.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="\"Thu Oct 7 17:36:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod pao_types.mod cell_types.mod cp_para_types.mod qs_environment_types.mod base_hooks.mod machine.mod message_passing.mod pao_ml_gaussprocess.mod pao_ml_descriptor.mod pao_input.mod pao_io.mod kinds.mod pao_ml_neuralnet.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 qs_density_mixing_types.mod cp_para_types.mod cp_fm_types.mod qs_mo_types.mod base_hooks.mod cp_gemm_interface.mod input_constants.mod message_passing.mod cp_fm_cholesky.mod cp_fm_basic_linalg.mod kinds.mod cp_fm_struct.mod cp_dbcsr_operations.mod cp_fm_diag.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="\"Thu Oct 7 17:36:29 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_density_mixing_types.mod cp_para_types.mod cp_fm_types.mod qs_mo_types.mod base_hooks.mod cp_gemm_interface.mod input_constants.mod message_passing.mod cp_fm_cholesky.mod cp_fm_basic_linalg.mod kinds.mod cp_fm_struct.mod cp_dbcsr_operations.mod cp_fm_diag.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_control_types.mod qs_neighbor_list_types.mod qs_density_mixing_types.mod pw_types.mod qs_rho_types.mod cp_para_types.mod distribution_1d_types.mod qs_environment_types.mod qs_rho_atom_types.mod base_hooks.mod message_passing.mod qs_scf_methods.mod kinds.mod cp_dbcsr_operations.mod cp_dbcsr_cp2k_link.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="\"Thu Oct 7 17:36:31 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_control_types.mod qs_neighbor_list_types.mod qs_density_mixing_types.mod pw_types.mod qs_rho_types.mod cp_para_types.mod distribution_1d_types.mod qs_environment_types.mod qs_rho_atom_types.mod base_hooks.mod message_passing.mod qs_scf_methods.mod kinds.mod cp_dbcsr_operations.mod cp_dbcsr_cp2k_link.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_control_types.mod pw_pool_types.mod pw_types.mod qs_density_mixing_types.mod qs_rho_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod qs_rho_atom_types.mod base_hooks.mod pw_methods.mod mathlib.mod message_passing.mod kinds.mod qs_scf_methods.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="\"Thu Oct 7 17:36:39 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_control_types.mod pw_pool_types.mod pw_types.mod qs_density_mixing_types.mod qs_rho_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod qs_rho_atom_types.mod base_hooks.mod pw_methods.mod mathlib.mod message_passing.mod kinds.mod qs_scf_methods.mod 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 cp_gemm_interface.mod input_constants.mod cp_fm_cholesky.mod cp_fm_basic_linalg.mod arnoldi_api.mod kinds.mod cp_fm_struct.mod cp_dbcsr_operations.mod cp_fm_diag.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="\"Thu Oct 7 17:36:53 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_gemm_interface.mod input_constants.mod cp_fm_cholesky.mod cp_fm_basic_linalg.mod arnoldi_api.mod kinds.mod cp_fm_struct.mod cp_dbcsr_operations.mod cp_fm_diag.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 preconditioner_types.mod cp_para_types.mod cp_fm_types.mod base_hooks.mod input_constants.mod cp_fm_basic_linalg.mod arnoldi_api.mod cp_fm_cholesky.mod cp_blacs_env.mod kinds.mod bibliography.mod cp_fm_struct.mod cp_dbcsr_operations.mod iterate_matrix.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="\"Thu Oct 7 17:36:55 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 preconditioner_types.mod cp_para_types.mod cp_fm_types.mod base_hooks.mod input_constants.mod cp_fm_basic_linalg.mod arnoldi_api.mod cp_fm_cholesky.mod cp_blacs_env.mod kinds.mod bibliography.mod cp_fm_struct.mod cp_dbcsr_operations.mod iterate_matrix.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 input_constants.mod cp_fm_cholesky.mod kinds.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="\"Thu Oct 7 17:36:56 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_constants.mod cp_fm_cholesky.mod kinds.mod cp_gemm_interface.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 preconditioner_types.mod cp_control_types.mod cp_para_types.mod qs_environment_types.mod cp_fm_types.mod qs_mo_types.mod base_hooks.mod preconditioner_makes.mod qs_mo_methods.mod input_constants.mod preconditioner_solvers.mod kinds.mod preconditioner_apply.mod cp_blacs_env.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="\"Thu Oct 7 17:36:56 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 preconditioner_types.mod cp_control_types.mod cp_para_types.mod qs_environment_types.mod cp_fm_types.mod qs_mo_types.mod base_hooks.mod preconditioner_makes.mod qs_mo_methods.mod input_constants.mod preconditioner_solvers.mod kinds.mod preconditioner_apply.mod cp_blacs_env.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 cp_fm_types.mod qs_mo_types.mod base_hooks.mod cp_gemm_interface.mod cp_log_handling.mod message_passing.mod cp_fm_cholesky.mod cp_fm_basic_linalg.mod kinds.mod cp_fm_struct.mod cp_fm_diag.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="\"Thu Oct 7 17:36:58 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_fm_types.mod qs_mo_types.mod base_hooks.mod cp_gemm_interface.mod cp_log_handling.mod message_passing.mod cp_fm_cholesky.mod cp_fm_basic_linalg.mod kinds.mod cp_fm_struct.mod cp_fm_diag.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 particle_types.mod atomic_kind_types.mod cell_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod kpoint_types.mod scf_control_types.mod qs_mo_types.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cryssym.mod util.mod input_constants.mod cp_log_handling.mod message_passing.mod fermi_utils.mod cp_dbcsr_cp2k_link.mod mathconstants.mod qs_matrix_pools.mod memory_utilities.mod cp_fm_basic_linalg.mod cp_para_env.mod cp_dbcsr_operations.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="\"Thu Oct 7 17:37:01 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod kpoint_types.mod scf_control_types.mod qs_mo_types.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cryssym.mod util.mod input_constants.mod cp_log_handling.mod message_passing.mod fermi_utils.mod cp_dbcsr_cp2k_link.mod mathconstants.mod qs_matrix_pools.mod memory_utilities.mod cp_fm_basic_linalg.mod cp_para_env.mod cp_dbcsr_operations.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 preconditioner_types.mod qs_block_davidson_types.mod cp_fm_types.mod qs_mo_types.mod base_hooks.mod cp_gemm_interface.mod machine.mod message_passing.mod preconditioner.mod cp_fm_cholesky.mod cp_fm_basic_linalg.mod kinds.mod cp_fm_struct.mod cp_dbcsr_operations.mod cp_fm_diag.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="\"Thu Oct 7 17:37:05 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 preconditioner_types.mod qs_block_davidson_types.mod cp_fm_types.mod qs_mo_types.mod base_hooks.mod cp_gemm_interface.mod machine.mod message_passing.mod preconditioner.mod cp_fm_cholesky.mod cp_fm_basic_linalg.mod kinds.mod cp_fm_struct.mod cp_dbcsr_operations.mod cp_fm_diag.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 preconditioner_types.mod qs_ot_types.mod base_hooks.mod message_passing.mod preconditioner.mod arnoldi_api.mod cp_dbcsr_cholesky.mod kinds.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="\"Thu Oct 7 17:37:08 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 preconditioner_types.mod qs_ot_types.mod base_hooks.mod message_passing.mod preconditioner.mod arnoldi_api.mod cp_dbcsr_cholesky.mod kinds.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 mathlib.mod cp_log_handling.mod qs_ot.mod preconditioner.mod kinds.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="\"Thu Oct 7 17:37:11 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathlib.mod cp_log_handling.mod qs_ot.mod preconditioner.mod kinds.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 preconditioner_types.mod qs_ot_types.mod cp_fm_types.mod base_hooks.mod qs_mo_methods.mod qs_ot_minimizer.mod cp_log_handling.mod qs_ot.mod kinds.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/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="\"Thu Oct 7 17:37:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 preconditioner_types.mod qs_ot_types.mod cp_fm_types.mod base_hooks.mod qs_mo_methods.mod qs_ot_minimizer.mod cp_log_handling.mod qs_ot.mod kinds.mod cp_dbcsr_cholesky.mod cp_dbcsr_operations.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 dm_ls_scf_types.mod cp_fm_types.mod cp_para_types.mod input_section_types.mod qs_diis_types.mod qs_environment_types.mod qs_mo_types.mod base_hooks.mod mathlib.mod string_utilities.mod cp_log_handling.mod cp_fm_basic_linalg.mod cp_output_handling.mod kinds.mod cp_fm_struct.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_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="\"Thu Oct 7 17:37:18 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 dm_ls_scf_types.mod cp_fm_types.mod cp_para_types.mod input_section_types.mod qs_diis_types.mod qs_environment_types.mod qs_mo_types.mod base_hooks.mod mathlib.mod string_utilities.mod cp_log_handling.mod cp_fm_basic_linalg.mod cp_output_handling.mod kinds.mod cp_fm_struct.mod cp_gemm_interface.mod cp_dbcsr_operations.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 cp_cfm_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_atom_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod qs_density_mixing_types.mod qs_energy_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mixing_utils.mod qs_mo_methods.mod cp_cfm_diag.mod qs_ks_methods.mod preconditioner.mod cp_fm_cholesky.mod cp_fm_struct.mod cp_gemm_interface.mod cp_cfm_basic_linalg.mod kinds.mod qs_scf_methods.mod input_constants.mod cp_log_handling.mod qs_scf_lanczos.mod kpoint_methods.mod cp_dbcsr_cp2k_link.mod qs_scf_block_davidson.mod qs_matrix_pools.mod cp_array_utils.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_gspace_mixing.mod qs_mo_occupation.mod cp_fm_diag.mod qs_ot_eigensolver.mod machine.mod qs_diis.mod qs_rho_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="\"Thu Oct 7 17:37:21 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_cfm_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_atom_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod qs_density_mixing_types.mod qs_energy_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mixing_utils.mod qs_mo_methods.mod cp_cfm_diag.mod qs_ks_methods.mod preconditioner.mod cp_fm_cholesky.mod cp_fm_struct.mod cp_gemm_interface.mod cp_cfm_basic_linalg.mod kinds.mod qs_scf_methods.mod input_constants.mod cp_log_handling.mod qs_scf_lanczos.mod kpoint_methods.mod cp_dbcsr_cp2k_link.mod qs_scf_block_davidson.mod qs_matrix_pools.mod cp_array_utils.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_gspace_mixing.mod qs_mo_occupation.mod cp_fm_diag.mod qs_ot_eigensolver.mod machine.mod qs_diis.mod qs_rho_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 cp_fm_types.mod qs_scf_types.mod scf_control_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod string_utilities.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod util.mod input_constants.mod bibliography.mod cp_fm_basic_linalg.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="\"Thu Oct 7 17:37:27 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_fm_types.mod qs_scf_types.mod scf_control_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod string_utilities.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod util.mod input_constants.mod bibliography.mod cp_fm_basic_linalg.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_para_types.mod cp_fm_types.mod qs_dftb_types.mod kpoint_types.mod qs_scf_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_files.mod cp_log_handling.mod message_passing.mod qs_mo_io.mod cp_output_handling.mod qs_dftb_utils.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/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="\"Thu Oct 7 17:37:30 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_para_types.mod cp_fm_types.mod qs_dftb_types.mod kpoint_types.mod qs_scf_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_files.mod cp_log_handling.mod message_passing.mod qs_mo_io.mod cp_output_handling.mod qs_dftb_utils.mod orbital_pointers.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 pw_pool_types.mod pw_types.mod pw_env_types.mod cp_control_types.mod cp_fm_pool_types.mod cp_fm_types.mod qs_ks_types.mod qs_wf_history_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod input_constants.mod cp_log_handling.mod bibliography.mod pw_methods.mod qs_matrix_pools.mod cp_fm_basic_linalg.mod cp_output_handling.mod mathlib.mod qs_rho_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_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="\"Thu Oct 7 17:37:32 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_pool_types.mod pw_types.mod pw_env_types.mod cp_control_types.mod cp_fm_pool_types.mod cp_fm_types.mod qs_ks_types.mod qs_wf_history_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod input_constants.mod cp_log_handling.mod bibliography.mod pw_methods.mod qs_matrix_pools.mod cp_fm_basic_linalg.mod cp_output_handling.mod mathlib.mod qs_rho_methods.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod xtb_types.mod cp_para_types.mod cp_fm_types.mod qs_mo_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod external_potential_types.mod scf_control_types.mod hfx_types.mod input_section_types.mod base_hooks.mod qs_mo_methods.mod cp_fm_cholesky.mod qs_mom_methods.mod cp_fm_struct.mod kinds.mod qs_scf_methods.mod util.mod input_constants.mod cp_log_handling.mod kpoint_io.mod message_passing.mod qs_mo_io.mod input_cp2k_hfx.mod cp_output_handling.mod qs_dftb_utils.mod qs_mo_occupation.mod particle_methods.mod qs_rho_methods.mod qs_wf_history_methods.mod cp_dbcsr_operations.mod atom_kind_orbitals.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="\"Thu Oct 7 17:37:36 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod xtb_types.mod cp_para_types.mod cp_fm_types.mod qs_mo_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod external_potential_types.mod scf_control_types.mod hfx_types.mod input_section_types.mod base_hooks.mod qs_mo_methods.mod cp_fm_cholesky.mod qs_mom_methods.mod cp_fm_struct.mod kinds.mod qs_scf_methods.mod util.mod input_constants.mod cp_log_handling.mod kpoint_io.mod message_passing.mod qs_mo_io.mod input_cp2k_hfx.mod cp_output_handling.mod qs_dftb_utils.mod qs_mo_occupation.mod particle_methods.mod qs_rho_methods.mod qs_wf_history_methods.mod cp_dbcsr_operations.mod atom_kind_orbitals.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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod qs_subsys_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_ks_types.mod qs_rho_atom_types.mod qs_rho_types.mod qs_environment_types.mod dm_ls_scf_types.mod particle_list_types.mod qs_density_mixing_types.mod qs_energy_types.mod base_hooks.mod qs_mixing_utils.mod qs_ks_methods.mod kinds.mod input_constants.mod cp_log_handling.mod qs_collocate_density.mod cp_dbcsr_cp2k_link.mod pw_methods.mod qs_gspace_mixing.mod cp_realspace_grid_cube.mod qs_rho_methods.mod qs_initial_guess.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="\"Thu Oct 7 17:37:44 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod qs_subsys_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_ks_types.mod qs_rho_atom_types.mod qs_rho_types.mod qs_environment_types.mod dm_ls_scf_types.mod particle_list_types.mod qs_density_mixing_types.mod qs_energy_types.mod base_hooks.mod qs_mixing_utils.mod qs_ks_methods.mod kinds.mod input_constants.mod cp_log_handling.mod qs_collocate_density.mod cp_dbcsr_cp2k_link.mod pw_methods.mod qs_gspace_mixing.mod cp_realspace_grid_cube.mod qs_rho_methods.mod qs_initial_guess.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 mathlib.mod input_constants.mod cp_log_handling.mod machine.mod dm_ls_scf_qs.mod arnoldi_api.mod kinds.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_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="\"Thu Oct 7 17:37:48 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathlib.mod input_constants.mod cp_log_handling.mod machine.mod dm_ls_scf_qs.mod arnoldi_api.mod kinds.mod iterate_matrix.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod dm_ls_scf_types.mod pao_types.mod qs_energy_types.mod base_hooks.mod ao_util.mod qs_ks_methods.mod kinds.mod iterate_matrix.mod pao_ml.mod cp_log_handling.mod message_passing.mod pao_param.mod bibliography.mod dm_ls_scf_qs.mod dm_ls_scf_methods.mod mathlib.mod machine.mod qs_rho_methods.mod qs_initial_guess.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="\"Thu Oct 7 17:37:51 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod dm_ls_scf_types.mod pao_types.mod qs_energy_types.mod base_hooks.mod ao_util.mod qs_ks_methods.mod kinds.mod iterate_matrix.mod pao_ml.mod cp_log_handling.mod message_passing.mod pao_param.mod bibliography.mod dm_ls_scf_qs.mod dm_ls_scf_methods.mod mathlib.mod machine.mod qs_rho_methods.mod qs_initial_guess.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 pao_types.mod input_section_types.mod qs_environment_types.mod base_hooks.mod machine.mod linesearch.mod pao_optimizer.mod pao_param.mod pao_input.mod bibliography.mod cp_external_control.mod kinds.mod pao_io.mod pao_methods.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="\"Thu Oct 7 17:37:58 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pao_types.mod input_section_types.mod qs_environment_types.mod base_hooks.mod machine.mod linesearch.mod pao_optimizer.mod pao_param.mod pao_input.mod bibliography.mod cp_external_control.mod kinds.mod pao_io.mod pao_methods.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 dm_ls_scf_types.mod pexsi_types.mod qs_energy_types.mod input_section_types.mod qs_environment_types.mod qs_ks_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod dm_ls_scf_qs.mod arnoldi_api.mod kinds.mod cp_dbcsr_operations.mod cp_dbcsr_cp2k_link.mod pexsi_interface.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="\"Thu Oct 7 17:38:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 dm_ls_scf_types.mod pexsi_types.mod qs_energy_types.mod input_section_types.mod qs_environment_types.mod qs_ks_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod dm_ls_scf_qs.mod arnoldi_api.mod kinds.mod cp_dbcsr_operations.mod cp_dbcsr_cp2k_link.mod pexsi_interface.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 particle_types.mod input_enumeration_types.mod molecule_types.mod pexsi_types.mod cp_control_types.mod input_keyword_types.mod qs_environment_types.mod dm_ls_scf_types.mod qs_density_mixing_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod bibliography.mod pao_main.mod cp_para_env.mod machine.mod pexsi_methods.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="\"Thu Oct 7 17:38:02 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod input_enumeration_types.mod molecule_types.mod pexsi_types.mod cp_control_types.mod input_keyword_types.mod qs_environment_types.mod dm_ls_scf_types.mod qs_density_mixing_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod bibliography.mod pao_main.mod cp_para_env.mod machine.mod pexsi_methods.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 qs_kind_types.mod particle_types.mod basis_set_types.mod qs_neighbor_list_types.mod block_p_types.mod cell_types.mod cp_para_types.mod input_section_types.mod qs_environment_types.mod base_hooks.mod ai_fermi_contact.mod cp_log_handling.mod cp_output_handling.mod kinds.mod cp_dbcsr_output.mod orbital_pointers.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="\"Thu Oct 7 17:38:14 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod basis_set_types.mod qs_neighbor_list_types.mod block_p_types.mod cell_types.mod cp_para_types.mod input_section_types.mod qs_environment_types.mod base_hooks.mod ai_fermi_contact.mod cp_log_handling.mod cp_output_handling.mod kinds.mod cp_dbcsr_output.mod orbital_pointers.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 qs_kind_types.mod particle_types.mod basis_set_types.mod qs_neighbor_list_types.mod block_p_types.mod cell_types.mod cp_para_types.mod input_section_types.mod qs_environment_types.mod base_hooks.mod cp_log_handling.mod cp_output_handling.mod kinds.mod cp_dbcsr_output.mod ai_elec_field.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="\"Thu Oct 7 17:38:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod basis_set_types.mod qs_neighbor_list_types.mod block_p_types.mod cell_types.mod cp_para_types.mod input_section_types.mod qs_environment_types.mod base_hooks.mod cp_log_handling.mod cp_output_handling.mod kinds.mod cp_dbcsr_output.mod ai_elec_field.mod orbital_pointers.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 qs_kind_types.mod particle_types.mod basis_set_types.mod qs_neighbor_list_types.mod block_p_types.mod cell_types.mod cp_para_types.mod input_section_types.mod qs_environment_types.mod base_hooks.mod cp_log_handling.mod ai_spin_orbit.mod cp_output_handling.mod kinds.mod cp_dbcsr_output.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="\"Thu Oct 7 17:38:18 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod basis_set_types.mod qs_neighbor_list_types.mod block_p_types.mod cell_types.mod cp_para_types.mod input_section_types.mod qs_environment_types.mod base_hooks.mod cp_log_handling.mod ai_spin_orbit.mod cp_output_handling.mod kinds.mod cp_dbcsr_output.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 cp_cfm_types.mod particle_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_linres_types.mod cp_fm_types.mod qs_environment_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_fermi_contact.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_cfm_basic_linalg.mod cp_log_handling.mod qs_elec_field.mod qs_operators_ao.mod cp_dbcsr_cp2k_link.mod mathconstants.mod qs_moments.mod cp_array_utils.mod cp_fm_basic_linalg.mod cp_output_handling.mod orbital_pointers.mod particle_methods.mod qs_spin_orbit.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="\"Thu Oct 7 17:38:20 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_cfm_types.mod particle_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_linres_types.mod cp_fm_types.mod qs_environment_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_fermi_contact.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_cfm_basic_linalg.mod cp_log_handling.mod qs_elec_field.mod qs_operators_ao.mod cp_dbcsr_cp2k_link.mod mathconstants.mod qs_moments.mod cp_array_utils.mod cp_fm_basic_linalg.mod cp_output_handling.mod orbital_pointers.mod particle_methods.mod qs_spin_orbit.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod paw_proj_set_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_linres_types.mod qs_rho_atom_types.mod qs_oce_types.mod qs_environment_types.mod sap_kind_types.mod base_hooks.mod qs_harmonics_atom.mod kinds.mod qs_linres_op.mod qs_oce_methods.mod util.mod input_constants.mod cp_log_handling.mod message_passing.mod qs_grid_atom.mod orbital_pointers.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="\"Thu Oct 7 17:38:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod paw_proj_set_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_linres_types.mod qs_rho_atom_types.mod qs_oce_types.mod qs_environment_types.mod sap_kind_types.mod base_hooks.mod qs_harmonics_atom.mod kinds.mod qs_linres_op.mod qs_oce_methods.mod util.mod input_constants.mod cp_log_handling.mod message_passing.mod qs_grid_atom.mod orbital_pointers.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 particle_types.mod basis_set_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_linres_types.mod cp_fm_types.mod qs_rho_types.mod qs_environment_types.mod particle_list_types.mod task_list_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod ao_util.mod cp_fm_struct.mod kinds.mod qs_linres_op.mod grid_api.mod input_constants.mod cp_log_handling.mod task_list_methods.mod qs_operators_ao.mod qs_linres_atom_current.mod gaussian_gridlevels.mod rs_pw_interface.mod cp_dbcsr_cp2k_link.mod pw_methods.mod mathconstants.mod qs_matrix_pools.mod cp_array_utils.mod memory_utilities.mod cp_fm_basic_linalg.mod cp_output_handling.mod orbital_pointers.mod cp_realspace_grid_cube.mod particle_methods.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_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="\"Thu Oct 7 17:38:40 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_linres_types.mod cp_fm_types.mod qs_rho_types.mod qs_environment_types.mod particle_list_types.mod task_list_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod ao_util.mod cp_fm_struct.mod kinds.mod qs_linres_op.mod grid_api.mod input_constants.mod cp_log_handling.mod task_list_methods.mod qs_operators_ao.mod qs_linres_atom_current.mod gaussian_gridlevels.mod rs_pw_interface.mod cp_dbcsr_cp2k_link.mod pw_methods.mod mathconstants.mod qs_matrix_pools.mod cp_array_utils.mod memory_utilities.mod cp_fm_basic_linalg.mod cp_output_handling.mod orbital_pointers.mod cp_realspace_grid_cube.mod particle_methods.mod cube_utils.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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod qs_subsys_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_linres_types.mod transport_env_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_log_handling.mod message_passing.mod bibliography.mod physcon.mod cp_dbcsr_cp2k_link.mod pw_methods.mod qs_linres_current.mod cp_output_handling.mod cp_realspace_grid_cube.mod particle_methods.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="\"Thu Oct 7 17:38:52 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod qs_subsys_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_linres_types.mod transport_env_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_log_handling.mod message_passing.mod bibliography.mod physcon.mod cp_dbcsr_cp2k_link.mod pw_methods.mod qs_linres_current.mod cp_output_handling.mod cp_realspace_grid_cube.mod particle_methods.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_kind_types.mod atomic_kind_types.mod qs_dispersion_types.mod input_section_types.mod qs_environment_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod cp_output_handling.mod qs_dispersion_pairpot.mod kinds.mod physcon.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="\"Thu Oct 7 17:38:56 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_kind_types.mod atomic_kind_types.mod qs_dispersion_types.mod input_section_types.mod qs_environment_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod cp_output_handling.mod qs_dispersion_pairpot.mod kinds.mod physcon.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 qs_kind_types.mod cp_control_types.mod semi_empirical_expns3_types.mod semi_empirical_types.mod base_hooks.mod input_constants.mod semi_empirical_utils.mod semi_empirical_int_arrays.mod kinds.mod semi_empirical_int3_utils.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="\"Thu Oct 7 17:38:58 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod cp_control_types.mod semi_empirical_expns3_types.mod semi_empirical_types.mod base_hooks.mod input_constants.mod semi_empirical_utils.mod semi_empirical_int_arrays.mod kinds.mod semi_empirical_int3_utils.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 mathconstants.mod memory_utilities.mod kinds.mod spherical_harmonics.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_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="\"Thu Oct 7 17:38:59 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathconstants.mod memory_utilities.mod kinds.mod spherical_harmonics.mod orbital_pointers.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 qs_kind_types.mod basis_set_types.mod cp_control_types.mod atomic_kind_types.mod input_section_types.mod qs_environment_types.mod lri_environment_types.mod base_hooks.mod mathlib.mod mathconstants.mod ao_util.mod generic_shg_integrals.mod generic_shg_integrals_init.mod bibliography.mod kinds.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="\"Thu Oct 7 17:39:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod basis_set_types.mod cp_control_types.mod atomic_kind_types.mod input_section_types.mod qs_environment_types.mod lri_environment_types.mod base_hooks.mod mathlib.mod mathconstants.mod ao_util.mod generic_shg_integrals.mod generic_shg_integrals_init.mod bibliography.mod kinds.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 pw_poisson_types.mod dg_types.mod pw_pool_types.mod input_section_types.mod pw_grid_types.mod ewald_environment_types.mod ewald_pw_types.mod dg_rho0_types.mod base_hooks.mod pw_poisson_methods.mod pw_grids.mod dgs.mod kinds.mod pw_poisson_read_input.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="\"Thu Oct 7 17:39:04 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_poisson_types.mod dg_types.mod pw_pool_types.mod input_section_types.mod pw_grid_types.mod ewald_environment_types.mod ewald_pw_types.mod dg_rho0_types.mod base_hooks.mod pw_poisson_methods.mod pw_grids.mod dgs.mod kinds.mod pw_poisson_read_input.mod 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_min_heap.mod input_constants.mod cp_log_handling.mod bibliography.mod kinds.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="\"Thu Oct 7 17:39:04 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_min_heap.mod input_constants.mod cp_log_handling.mod bibliography.mod kinds.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 distribution_2d_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qs_kind_types.mod kg_environment_types.mod qs_neighbor_list_types.mod cp_para_types.mod distribution_1d_types.mod qs_environment_types.mod external_potential_types.mod integration_grid_types.mod task_list_types.mod input_section_types.mod base_hooks.mod qs_neighbor_lists.mod string_utilities.mod kinds.mod cp_files.mod util.mod input_constants.mod cp_log_handling.mod message_passing.mod bibliography.mod lri_environment_init.mod qs_grid_atom.mod kg_vertex_coloring_methods.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="\"Thu Oct 7 17:39:06 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 distribution_2d_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qs_kind_types.mod kg_environment_types.mod qs_neighbor_list_types.mod cp_para_types.mod distribution_1d_types.mod qs_environment_types.mod external_potential_types.mod integration_grid_types.mod task_list_types.mod input_section_types.mod base_hooks.mod qs_neighbor_lists.mod string_utilities.mod kinds.mod cp_files.mod util.mod input_constants.mod cp_log_handling.mod message_passing.mod bibliography.mod lri_environment_init.mod qs_grid_atom.mod kg_vertex_coloring_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 mathlib.mod input_constants.mod cp_log_handling.mod cp_output_handling.mod cp_eri_mme_interface.mod kinds.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="\"Thu Oct 7 17:39:10 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathlib.mod input_constants.mod cp_log_handling.mod cp_output_handling.mod cp_eri_mme_interface.mod kinds.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 input_cp2k_check.mod base_hooks.mod input_constants.mod xc_derivatives.mod xc_libxc.mod kinds.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="\"Thu Oct 7 17:39:10 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_cp2k_check.mod base_hooks.mod input_constants.mod xc_derivatives.mod xc_libxc.mod kinds.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 input_enumeration_types.mod cp_control_types.mod input_keyword_types.mod input_section_types.mod pair_potential_types.mod xc_write_output.mod base_hooks.mod string_utilities.mod kinds.mod cp_files.mod util.mod input_cp2k_check.mod input_constants.mod cp_log_handling.mod bibliography.mod periodic_table.mod mathconstants.mod xc_derivatives.mod xc_input_constants.mod cp_output_handling.mod qs_cdft_utils.mod cp_units.mod input_cp2k_dft.mod force_fields_input.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="\"Thu Oct 7 17:39:11 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_enumeration_types.mod cp_control_types.mod input_keyword_types.mod input_section_types.mod pair_potential_types.mod xc_write_output.mod base_hooks.mod string_utilities.mod kinds.mod cp_files.mod util.mod input_cp2k_check.mod input_constants.mod cp_log_handling.mod bibliography.mod periodic_table.mod mathconstants.mod xc_derivatives.mod xc_input_constants.mod cp_output_handling.mod qs_cdft_utils.mod cp_units.mod input_cp2k_dft.mod force_fields_input.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 basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod basis_set_container_types.mod ec_env_types.mod qs_environment_types.mod qs_dispersion_types.mod input_section_types.mod base_hooks.mod qs_interactions.mod string_utilities.mod kinds.mod qs_dispersion_utils.mod input_cp2k_check.mod input_constants.mod qs_dispersion_pairpot.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="\"Thu Oct 7 17:39:14 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod basis_set_container_types.mod ec_env_types.mod qs_environment_types.mod qs_dispersion_types.mod input_section_types.mod base_hooks.mod qs_interactions.mod string_utilities.mod kinds.mod qs_dispersion_utils.mod input_cp2k_check.mod input_constants.mod qs_dispersion_pairpot.mod orbital_pointers.mod qs_dispersion_nonloc.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 cp_control_types.mod input_section_types.mod qs_environment_types.mod base_hooks.mod input_constants.mod kinds.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="\"Thu Oct 7 17:39:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_control_types.mod input_section_types.mod qs_environment_types.mod base_hooks.mod input_constants.mod kinds.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 qs_kind_types.mod basis_set_types.mod cp_para_types.mod input_section_types.mod qs_environment_types.mod qs_gcp_types.mod cp_parser_types.mod base_hooks.mod mathconstants.mod sto_ng.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/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="\"Thu Oct 7 17:39:18 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod basis_set_types.mod cp_para_types.mod input_section_types.mod qs_environment_types.mod qs_gcp_types.mod cp_parser_types.mod base_hooks.mod mathconstants.mod sto_ng.mod kinds.mod cp_parser_methods.mod periodic_table.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 cp_control_types.mod qs_neighbor_list_types.mod pw_types.mod task_list_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod qs_ks_types.mod base_hooks.mod pw_methods.mod input_constants.mod task_list_methods.mod qs_rho_methods.mod qs_collocate_density.mod cp_ddapc_util.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="\"Thu Oct 7 17:39:20 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_control_types.mod qs_neighbor_list_types.mod pw_types.mod task_list_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod qs_ks_types.mod base_hooks.mod pw_methods.mod input_constants.mod task_list_methods.mod qs_rho_methods.mod qs_collocate_density.mod cp_ddapc_util.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 qs_kind_types.mod particle_types.mod virial_types.mod basis_set_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod qs_force_types.mod sap_kind_types.mod external_potential_types.mod base_hooks.mod virial_methods.mod ai_overlap.mod kinds.mod orbital_pointers.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="\"Thu Oct 7 17:39:22 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod virial_types.mod basis_set_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod qs_force_types.mod sap_kind_types.mod external_potential_types.mod base_hooks.mod virial_methods.mod ai_overlap.mod kinds.mod orbital_pointers.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 qs_kind_types.mod particle_types.mod virial_types.mod basis_set_types.mod kg_environment_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod qs_force_types.mod external_potential_types.mod base_hooks.mod ai_overlap_ppl.mod virial_methods.mod particle_methods.mod kinds.mod cp_dbcsr_operations.mod orbital_pointers.mod cp_dbcsr_cp2k_link.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="\"Thu Oct 7 17:39:29 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod virial_types.mod basis_set_types.mod kg_environment_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod qs_force_types.mod external_potential_types.mod base_hooks.mod ai_overlap_ppl.mod virial_methods.mod particle_methods.mod kinds.mod cp_dbcsr_operations.mod orbital_pointers.mod cp_dbcsr_cp2k_link.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 basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_ks_types.mod virial_types.mod kpoint_types.mod qs_force_types.mod base_hooks.mod virial_methods.mod kinds.mod ai_contraction.mod ai_kinetic.mod qs_overlap.mod orbital_pointers.mod qs_integral_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_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="\"Thu Oct 7 17:39:32 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_ks_types.mod virial_types.mod kpoint_types.mod qs_force_types.mod base_hooks.mod virial_methods.mod kinds.mod ai_contraction.mod ai_kinetic.mod qs_overlap.mod orbital_pointers.mod qs_integral_utils.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 qs_kind_types.mod particle_types.mod external_potential_types.mod virial_types.mod basis_set_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod qs_force_types.mod base_hooks.mod virial_methods.mod kinds.mod ai_verfc.mod orbital_pointers.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="\"Thu Oct 7 17:39:35 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod external_potential_types.mod virial_types.mod basis_set_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod qs_force_types.mod base_hooks.mod virial_methods.mod kinds.mod ai_verfc.mod orbital_pointers.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 particle_types.mod atomic_kind_types.mod qs_kind_types.mod kg_environment_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_ks_types.mod virial_types.mod qs_oce_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod input_section_types.mod qs_force_types.mod lri_environment_types.mod base_hooks.mod cp_blacs_env.mod kinds.mod qs_oce_methods.mod core_ppnl.mod input_constants.mod cp_log_handling.mod cp_dbcsr_output.mod kg_tnadd_mat.mod cp_dbcsr_cp2k_link.mod qs_overlap.mod cp_output_handling.mod qs_kinetic.mod qs_condnum.mod core_ppl.mod core_ae.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="\"Thu Oct 7 17:39:40 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod qs_kind_types.mod kg_environment_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_ks_types.mod virial_types.mod qs_oce_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod input_section_types.mod qs_force_types.mod lri_environment_types.mod base_hooks.mod cp_blacs_env.mod kinds.mod qs_oce_methods.mod core_ppnl.mod input_constants.mod cp_log_handling.mod cp_dbcsr_output.mod kg_tnadd_mat.mod cp_dbcsr_cp2k_link.mod qs_overlap.mod cp_output_handling.mod qs_kinetic.mod qs_condnum.mod core_ppl.mod core_ae.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 scf_control_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_fm_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod qs_mo_types.mod base_hooks.mod qs_ks_methods.mod kpoint_methods.mod cp_fm_struct.mod kinds.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="\"Thu Oct 7 17:39:44 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 scf_control_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_fm_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod qs_mo_types.mod base_hooks.mod qs_ks_methods.mod kpoint_methods.mod cp_fm_struct.mod kinds.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 particle_types.mod atomic_kind_types.mod qs_subsys_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod input_section_types.mod qs_force_types.mod qs_mo_types.mod base_hooks.mod qs_mixing_utils.mod qs_mo_methods.mod qs_neighbor_lists.mod qs_ks_methods.mod qs_update_s_mstruct.mod kinds.mod cp_log_handling.mod qs_core_hamiltonian.mod qs_rho_methods.mod cp_dbcsr_operations.mod qs_energy_matrix_w.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="\"Thu Oct 7 17:39:46 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod qs_subsys_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod input_section_types.mod qs_force_types.mod qs_mo_types.mod base_hooks.mod qs_mixing_utils.mod qs_mo_methods.mod qs_neighbor_lists.mod qs_ks_methods.mod qs_update_s_mstruct.mod kinds.mod cp_log_handling.mod qs_core_hamiltonian.mod qs_rho_methods.mod cp_dbcsr_operations.mod qs_energy_matrix_w.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 scf_control_types.mod qs_cdft_types.mod cp_control_types.mod qs_cdft_opt_types.mod qs_scf_types.mod qs_energy_types.mod qs_environment_types.mod base_hooks.mod mathlib.mod input_constants.mod cp_log_handling.mod qs_basis_gradient.mod kinds.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="\"Thu Oct 7 17:39:49 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 scf_control_types.mod qs_cdft_types.mod cp_control_types.mod qs_cdft_opt_types.mod qs_scf_types.mod qs_energy_types.mod qs_environment_types.mod base_hooks.mod mathlib.mod input_constants.mod cp_log_handling.mod qs_basis_gradient.mod kinds.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 basis_set_types.mod pw_pool_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod qs_rho0_types.mod cp_para_types.mod ps_wavelet_types.mod pw_grid_types.mod dielectric_types.mod ps_implicit_types.mod qs_environment_types.mod pw_poisson_types.mod qs_dispersion_types.mod input_section_types.mod base_hooks.mod ao_util.mod kinds.mod pw_poisson_read_input.mod input_constants.mod cp_log_handling.mod pw_grids.mod pw_grid_info.mod gaussian_gridlevels.mod xc_input_constants.mod d3_poly.mod cp_output_handling.mod pw_poisson_methods.mod cube_utils.mod cp_realspace_grid_init.mod dct.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="\"Thu Oct 7 17:39:55 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 basis_set_types.mod pw_pool_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod qs_rho0_types.mod cp_para_types.mod ps_wavelet_types.mod pw_grid_types.mod dielectric_types.mod ps_implicit_types.mod qs_environment_types.mod pw_poisson_types.mod qs_dispersion_types.mod input_section_types.mod base_hooks.mod ao_util.mod kinds.mod pw_poisson_read_input.mod input_constants.mod cp_log_handling.mod pw_grids.mod pw_grid_info.mod gaussian_gridlevels.mod xc_input_constants.mod d3_poly.mod cp_output_handling.mod pw_poisson_methods.mod cube_utils.mod cp_realspace_grid_init.mod dct.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 distribution_2d_types.mod particle_types.mod atomic_kind_types.mod pw_pool_types.mod molecule_types.mod pw_types.mod cell_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_rho0_types.mod cp_para_types.mod qs_ks_types.mod molecule_kind_types.mod ewald_environment_types.mod ewald_pw_types.mod qs_charges_types.mod qs_environment_types.mod scf_control_types.mod base_hooks.mod cp_blacs_env.mod distribution_methods.mod kinds.mod input_constants.mod qs_rho0_ggrid.mod qs_outer_scf.mod qs_matrix_pools.mod ewald_pw_methods.mod pw_env_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_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="\"Thu Oct 7 17:39:57 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 distribution_2d_types.mod particle_types.mod atomic_kind_types.mod pw_pool_types.mod molecule_types.mod pw_types.mod cell_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_rho0_types.mod cp_para_types.mod qs_ks_types.mod molecule_kind_types.mod ewald_environment_types.mod ewald_pw_types.mod qs_charges_types.mod qs_environment_types.mod scf_control_types.mod base_hooks.mod cp_blacs_env.mod distribution_methods.mod kinds.mod input_constants.mod qs_rho0_ggrid.mod qs_outer_scf.mod qs_matrix_pools.mod ewald_pw_methods.mod pw_env_methods.mod cp_dbcsr_operations.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 molecule_types.mod semi_empirical_mpole_types.mod multipole_types.mod basis_set_container_types.mod molecule_kind_types.mod ewald_environment_types.mod ewald_pw_types.mod fist_nonbond_env_types.mod external_potential_types.mod qs_dispersion_types.mod qs_energy_types.mod input_section_types.mod rel_control_types.mod basis_set_types.mod qs_subsys_types.mod pw_env_types.mod cp_para_types.mod qs_rho_atom_types.mod kpoint_types.mod cp_subsys_types.mod qs_gcp_types.mod cp_ddapc_types.mod atomic_kind_types.mod semi_empirical_store_int_types.mod mp2_types.mod xtb_types.mod et_coupling_types.mod qs_ks_types.mod global_types.mod qs_environment_types.mod scf_control_types.mod hfx_types.mod particle_types.mod cell_types.mod qmmm_types_low.mod semi_empirical_types.mod qs_kind_types.mod cp_control_types.mod qs_local_rho_types.mod qs_rho0_types.mod ec_env_types.mod qs_dftb_types.mod qs_wf_history_types.mod distribution_1d_types.mod qs_force_types.mod lri_environment_types.mod qs_mo_types.mod base_hooks.mod orbital_transformation_matrices.mod gamma.mod xtb_parameters.mod semi_empirical_int_arrays.mod mathconstants.mod cp_output_handling.mod orbital_pointers.mod cp_para_env.mod particle_methods.mod qs_dftb_parameters.mod dm_ls_scf_create.mod qs_subsys_methods.mod transport.mod qs_dispersion_utils.mod qs_rho_atom_methods.mod qs_dispersion_pairpot.mod kpoint_methods.mod semi_empirical_mpole_methods.mod semi_empirical_expns3_methods.mod lri_environment_init.mod auto_basis.mod qs_dispersion_nonloc.mod semi_empirical_utils.mod cp_blacs_env.mod header.mod input_constants.mod cp_log_handling.mod bibliography.mod ewald_pw_methods.mod kg_environment.mod mp2_setup.mod qs_interactions.mod distribution_methods.mod kinds.mod cp_control_utils.mod atom_kind_orbitals.mod ec_environment.mod qs_rho0_ggrid.mod hartree_local_methods.mod qs_rho0_methods.mod almo_scf_env_methods.mod qs_gcp_utils.mod cp_symmetry.mod qs_environment_methods.mod machine.mod qs_wf_history_methods.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="\"Thu Oct 7 17:40:01 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 molecule_types.mod semi_empirical_mpole_types.mod multipole_types.mod basis_set_container_types.mod molecule_kind_types.mod ewald_environment_types.mod ewald_pw_types.mod fist_nonbond_env_types.mod external_potential_types.mod qs_dispersion_types.mod qs_energy_types.mod input_section_types.mod rel_control_types.mod basis_set_types.mod qs_subsys_types.mod pw_env_types.mod cp_para_types.mod qs_rho_atom_types.mod kpoint_types.mod cp_subsys_types.mod qs_gcp_types.mod cp_ddapc_types.mod atomic_kind_types.mod semi_empirical_store_int_types.mod mp2_types.mod xtb_types.mod et_coupling_types.mod qs_ks_types.mod global_types.mod qs_environment_types.mod scf_control_types.mod hfx_types.mod particle_types.mod cell_types.mod qmmm_types_low.mod semi_empirical_types.mod qs_kind_types.mod cp_control_types.mod qs_local_rho_types.mod qs_rho0_types.mod ec_env_types.mod qs_dftb_types.mod qs_wf_history_types.mod distribution_1d_types.mod qs_force_types.mod lri_environment_types.mod qs_mo_types.mod base_hooks.mod orbital_transformation_matrices.mod gamma.mod xtb_parameters.mod semi_empirical_int_arrays.mod mathconstants.mod cp_output_handling.mod orbital_pointers.mod cp_para_env.mod particle_methods.mod qs_dftb_parameters.mod dm_ls_scf_create.mod qs_subsys_methods.mod transport.mod qs_dispersion_utils.mod qs_rho_atom_methods.mod qs_dispersion_pairpot.mod kpoint_methods.mod semi_empirical_mpole_methods.mod semi_empirical_expns3_methods.mod lri_environment_init.mod auto_basis.mod qs_dispersion_nonloc.mod semi_empirical_utils.mod cp_blacs_env.mod header.mod input_constants.mod cp_log_handling.mod bibliography.mod ewald_pw_methods.mod kg_environment.mod mp2_setup.mod qs_interactions.mod distribution_methods.mod kinds.mod cp_control_utils.mod atom_kind_orbitals.mod ec_environment.mod qs_rho0_ggrid.mod hartree_local_methods.mod qs_rho0_methods.mod almo_scf_env_methods.mod qs_gcp_utils.mod cp_symmetry.mod qs_environment_methods.mod machine.mod qs_wf_history_methods.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 particle_types.mod molecule_kind_types.mod embed_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod cp_para_types.mod input_section_types.mod distribution_1d_types.mod cp_subsys_types.mod base_hooks.mod cp_subsys_methods.mod cell_methods.mod distribution_methods.mod kinds.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="\"Thu Oct 7 17:40:10 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod molecule_kind_types.mod embed_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod cp_para_types.mod input_section_types.mod distribution_1d_types.mod cp_subsys_types.mod base_hooks.mod cp_subsys_methods.mod cell_methods.mod distribution_methods.mod kinds.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 embed_types.mod cp_para_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod embed_environment.mod cp_output_handling.mod kinds.mod cp_files.mod cp_para_env.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="\"Thu Oct 7 17:40:11 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 embed_types.mod cp_para_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod embed_environment.mod cp_output_handling.mod kinds.mod cp_files.mod cp_para_env.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 particle_types.mod qmmm_types_low.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="\"Thu Oct 7 17:40:12 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod qmmm_types_low.mod base_hooks.mod cp_log_handling.mod kinds.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 particle_types.mod force_field_types.mod cp_para_types.mod force_field_kind_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod string_utilities.mod cp_log_handling.mod topology_amber.mod cp_units.mod memory_utilities.mod cp_output_handling.mod kinds.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_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="\"Thu Oct 7 17:40:13 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod force_field_types.mod cp_para_types.mod force_field_kind_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod string_utilities.mod cp_log_handling.mod topology_amber.mod cp_units.mod memory_utilities.mod cp_output_handling.mod kinds.mod cp_parser_methods.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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qmmm_types_low.mod force_field_types.mod cp_para_types.mod force_field_kind_types.mod molecule_kind_types.mod ewald_environment_types.mod fist_nonbond_env_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod cp_output_handling.mod force_fields_ext.mod force_fields_util.mod cp_units.mod force_fields_input.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="\"Thu Oct 7 17:40:15 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qmmm_types_low.mod force_field_types.mod cp_para_types.mod force_field_kind_types.mod molecule_kind_types.mod ewald_environment_types.mod fist_nonbond_env_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod cp_output_handling.mod force_fields_ext.mod force_fields_util.mod cp_units.mod force_fields_input.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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qmmm_types_low.mod multipole_types.mod exclusion_types.mod cp_para_types.mod fist_energy_types.mod molecule_kind_types.mod fist_environment_types.mod fist_efield_types.mod distribution_1d_types.mod ewald_environment_types.mod cp_subsys_types.mod ewald_pw_types.mod fist_nonbond_env_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod force_fields.mod distribution_methods.mod kinds.mod header.mod cp_subsys_methods.mod cp_log_handling.mod bibliography.mod cp_output_handling.mod cell_methods.mod cp_symmetry.mod ewald_pw_methods.mod particle_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="\"Thu Oct 7 17:40:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qmmm_types_low.mod multipole_types.mod exclusion_types.mod cp_para_types.mod fist_energy_types.mod molecule_kind_types.mod fist_environment_types.mod fist_efield_types.mod distribution_1d_types.mod ewald_environment_types.mod cp_subsys_types.mod ewald_pw_types.mod fist_nonbond_env_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod force_fields.mod distribution_methods.mod kinds.mod header.mod cp_subsys_methods.mod cp_log_handling.mod bibliography.mod cp_output_handling.mod cell_methods.mod cp_symmetry.mod ewald_pw_methods.mod particle_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="\"Thu Oct 7 17:40:18 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qmmm_gaussian_types.mod input_section_types.mod cp_para_types.mod cp_parser_types.mod base_hooks.mod string_utilities.mod mathconstants.mod cp_log_handling.mod qmmm_gaussian_data.mod kinds.mod cp_parser_methods.mod physcon.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="\"Thu Oct 7 17:40:18 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qmmm_gaussian_types.mod input_section_types.mod cp_para_types.mod cp_parser_types.mod base_hooks.mod string_utilities.mod mathconstants.mod cp_log_handling.mod qmmm_gaussian_data.mod kinds.mod cp_parser_methods.mod physcon.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 qmmm_gaussian_types.mod pw_pool_types.mod cp_para_types.mod input_section_types.mod pw_env_types.mod qmmm_gaussian_input.mod base_hooks.mod input_constants.mod cp_log_handling.mod ao_util.mod memory_utilities.mod cp_output_handling.mod qmmm_gaussian_data.mod gaussian_gridlevels.mod kinds.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="\"Thu Oct 7 17:40:20 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qmmm_gaussian_types.mod pw_pool_types.mod cp_para_types.mod input_section_types.mod pw_env_types.mod qmmm_gaussian_input.mod base_hooks.mod input_constants.mod cp_log_handling.mod ao_util.mod memory_utilities.mod cp_output_handling.mod qmmm_gaussian_data.mod gaussian_gridlevels.mod kinds.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 cell_types.mod input_section_types.mod qmmm_types_low.mod base_hooks.mod input_constants.mod cp_log_handling.mod mathconstants.mod memory_utilities.mod cp_output_handling.mod kinds.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="\"Thu Oct 7 17:40:21 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cell_types.mod input_section_types.mod qmmm_types_low.mod base_hooks.mod input_constants.mod cp_log_handling.mod mathconstants.mod memory_utilities.mod cp_output_handling.mod kinds.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 pw_poisson_types.mod qmmm_gaussian_types.mod cell_types.mod cp_para_types.mod input_section_types.mod qmmm_types_low.mod ewald_environment_types.mod ewald_pw_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod mathconstants.mod ao_util.mod cp_output_handling.mod ewald_spline_util.mod kinds.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="\"Thu Oct 7 17:40:22 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_poisson_types.mod qmmm_gaussian_types.mod cell_types.mod cp_para_types.mod input_section_types.mod qmmm_types_low.mod ewald_environment_types.mod ewald_pw_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod mathconstants.mod ao_util.mod cp_output_handling.mod ewald_spline_util.mod kinds.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 particle_types.mod atomic_kind_types.mod cell_types.mod pw_env_types.mod qmmm_types_low.mod cp_control_types.mod force_field_types.mod cp_para_types.mod molecule_kind_types.mod atomic_kind_list_types.mod shell_potential_types.mod qs_environment_types.mod cp_subsys_types.mod external_potential_types.mod particle_list_types.mod input_section_types.mod pair_potential_types.mod base_hooks.mod cp_eri_mme_interface.mod kinds.mod qmmm_gaussian_init.mod input_constants.mod cp_log_handling.mod qmmm_elpot.mod cp_output_handling.mod cell_methods.mod qmmm_ff_fist.mod cp_units.mod qmmm_per_elpot.mod force_fields_input.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="\"Thu Oct 7 17:40:24 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod pw_env_types.mod qmmm_types_low.mod cp_control_types.mod force_field_types.mod cp_para_types.mod molecule_kind_types.mod atomic_kind_list_types.mod shell_potential_types.mod qs_environment_types.mod cp_subsys_types.mod external_potential_types.mod particle_list_types.mod input_section_types.mod pair_potential_types.mod base_hooks.mod cp_eri_mme_interface.mod kinds.mod qmmm_gaussian_init.mod input_constants.mod cp_log_handling.mod qmmm_elpot.mod cp_output_handling.mod cell_methods.mod qmmm_ff_fist.mod cp_units.mod qmmm_per_elpot.mod force_fields_input.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_pool_types.mod pw_env_types.mod pw_grid_types.mod qmmm_types_low.mod base_hooks.mod input_constants.mod message_passing.mod pw_grids.mod kinds.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="\"Thu Oct 7 17:40:28 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_pool_types.mod pw_env_types.mod pw_grid_types.mod qmmm_types_low.mod base_hooks.mod input_constants.mod message_passing.mod pw_grids.mod kinds.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 cell_types.mod pw_env_types.mod qmmm_types_low.mod cp_para_types.mod global_types.mod qmmm_types.mod fist_environment_types.mod fist_nonbond_env_types.mod qs_environment_types.mod cp_subsys_types.mod input_section_types.mod base_hooks.mod qs_environment.mod kinds.mod header.mod cp_subsys_methods.mod cp_log_handling.mod input_constants.mod qmmm_links_methods.mod bibliography.mod cp_output_handling.mod cell_methods.mod fist_environment.mod qmmm_init.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="\"Thu Oct 7 17:40:29 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cell_types.mod pw_env_types.mod qmmm_types_low.mod cp_para_types.mod global_types.mod qmmm_types.mod fist_environment_types.mod fist_nonbond_env_types.mod qs_environment_types.mod cp_subsys_types.mod input_section_types.mod base_hooks.mod qs_environment.mod kinds.mod header.mod cp_subsys_methods.mod cp_log_handling.mod input_constants.mod qmmm_links_methods.mod bibliography.mod cp_output_handling.mod cell_methods.mod fist_environment.mod qmmm_init.mod qmmm_pw_grid.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 global_types.mod qmmmx_types.mod qmmm_types.mod cp_para_types.mod input_section_types.mod cp_subsys_types.mod base_hooks.mod qmmmx_util.mod qmmm_create.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="\"Thu Oct 7 17:40:31 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 global_types.mod qmmmx_types.mod qmmm_types.mod cp_para_types.mod input_section_types.mod cp_subsys_types.mod base_hooks.mod qmmmx_util.mod qmmm_create.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 mixed_energy_types.mod particle_types.mod molecule_kind_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod cp_para_types.mod input_section_types.mod distribution_1d_types.mod cp_subsys_types.mod mixed_environment_types.mod base_hooks.mod cp_subsys_methods.mod cell_methods.mod distribution_methods.mod kinds.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="\"Thu Oct 7 17:40:33 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mixed_energy_types.mod particle_types.mod molecule_kind_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod cp_para_types.mod input_section_types.mod distribution_1d_types.mod cp_subsys_types.mod mixed_environment_types.mod base_hooks.mod cp_subsys_methods.mod cell_methods.mod distribution_methods.mod kinds.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 input_section_types.mod mixed_environment_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod mixed_environment.mod cp_output_handling.mod kinds.mod cp_files.mod cp_para_env.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="\"Thu Oct 7 17:40:34 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_section_types.mod mixed_environment_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod mixed_environment.mod cp_output_handling.mod kinds.mod cp_files.mod cp_para_env.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 particle_types.mod molecule_kind_types.mod molecule_kind_list_types.mod particle_list_types.mod force_env_types.mod molecule_types.mod distribution_1d_types.mod cp_subsys_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="\"Thu Oct 7 17:40:35 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod molecule_kind_types.mod molecule_kind_list_types.mod particle_list_types.mod force_env_types.mod molecule_types.mod distribution_1d_types.mod cp_subsys_types.mod molecule_list_types.mod base_hooks.mod kinds.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 molecule_kind_types.mod molecule_types.mod cell_types.mod input_section_types.mod base_hooks.mod mathlib.mod colvar_methods.mod kinds.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="\"Thu Oct 7 17:40:37 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 molecule_kind_types.mod molecule_types.mod cell_types.mod input_section_types.mod base_hooks.mod mathlib.mod colvar_methods.mod kinds.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 particle_types.mod molecule_kind_types.mod virial_types.mod molecule_types.mod cell_types.mod distribution_1d_types.mod base_hooks.mod mathlib.mod message_passing.mod colvar_methods.mod kinds.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="\"Thu Oct 7 17:40:39 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod molecule_kind_types.mod virial_types.mod molecule_types.mod cell_types.mod distribution_1d_types.mod base_hooks.mod mathlib.mod message_passing.mod colvar_methods.mod kinds.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 '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 molecule_kind_types.mod atomic_kind_types.mod molecule_types.mod base_hooks.mod mathlib.mod constraint_fxd.mod kinds.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="\"Thu Oct 7 17:40:42 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 molecule_kind_types.mod atomic_kind_types.mod molecule_types.mod base_hooks.mod mathlib.mod constraint_fxd.mod kinds.mod linear_systems.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 molecule_kind_types.mod atomic_kind_types.mod molecule_types.mod base_hooks.mod mathlib.mod constraint_fxd.mod kinds.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="\"Thu Oct 7 17:40:49 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 molecule_kind_types.mod atomic_kind_types.mod molecule_types.mod base_hooks.mod mathlib.mod constraint_fxd.mod kinds.mod linear_systems.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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod cp_para_types.mod colvar_types.mod molecule_kind_types.mod distribution_1d_types.mod input_section_types.mod simpar_types.mod base_hooks.mod constraint_vsite.mod constraint_clv.mod kinds.mod constraint_util.mod input_constants.mod cp_log_handling.mod message_passing.mod memory_utilities.mod constraint_4x6.mod constraint_3x3.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="\"Thu Oct 7 17:40:53 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod cp_para_types.mod colvar_types.mod molecule_kind_types.mod distribution_1d_types.mod input_section_types.mod simpar_types.mod base_hooks.mod constraint_vsite.mod constraint_clv.mod kinds.mod constraint_util.mod input_constants.mod cp_log_handling.mod message_passing.mod memory_utilities.mod constraint_4x6.mod constraint_3x3.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 particle_types.mod molecule_kind_list_types.mod particle_list_types.mod force_env_types.mod molecule_types.mod atomic_kind_list_types.mod cell_types.mod input_section_types.mod distribution_1d_types.mod cp_subsys_types.mod molecule_list_types.mod base_hooks.mod kinds.mod constraint.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="\"Thu Oct 7 17:40:57 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod molecule_kind_list_types.mod particle_list_types.mod force_env_types.mod molecule_types.mod atomic_kind_list_types.mod cell_types.mod input_section_types.mod distribution_1d_types.mod cp_subsys_types.mod molecule_list_types.mod base_hooks.mod kinds.mod constraint.mod constraint_util.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 xc_rho_set_types.mod particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod force_env_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod pw_poisson_types.mod particle_list_types.mod embed_types.mod input_section_types.mod lri_environment_types.mod qs_mo_types.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod cp_files.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod qs_collocate_density.mod pw_methods.mod mathconstants.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_kinetic.mod mixed_environment_utils.mod qs_integrate_potential_single.mod cp_fm_diag.mod cp_realspace_grid_cube.mod pw_poisson_methods.mod xc.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="\"Thu Oct 7 17:41:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 xc_rho_set_types.mod particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod force_env_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod pw_poisson_types.mod particle_list_types.mod embed_types.mod input_section_types.mod lri_environment_types.mod qs_mo_types.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod cp_files.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod qs_collocate_density.mod pw_methods.mod mathconstants.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_kinetic.mod mixed_environment_utils.mod qs_integrate_potential_single.mod cp_fm_diag.mod cp_realspace_grid_cube.mod pw_poisson_methods.mod xc.mod cp_dbcsr_operations.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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod structure_factor_types.mod cell_types.mod realspace_grid_types.mod pw_grid_types.mod atprop_types.mod shell_potential_types.mod ewald_environment_types.mod ewald_pw_types.mod dg_rho0_types.mod pw_poisson_types.mod dg_types.mod base_hooks.mod pme_tools.mod structure_factors.mod dgs.mod kinds.mod bibliography.mod pw_methods.mod mathconstants.mod pw_poisson_methods.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="\"Thu Oct 7 17:41:08 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod structure_factor_types.mod cell_types.mod realspace_grid_types.mod pw_grid_types.mod atprop_types.mod shell_potential_types.mod ewald_environment_types.mod ewald_pw_types.mod dg_rho0_types.mod pw_poisson_types.mod dg_types.mod base_hooks.mod pme_tools.mod structure_factors.mod dgs.mod kinds.mod bibliography.mod pw_methods.mod mathconstants.mod pw_poisson_methods.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 pw_poisson_types.mod particle_types.mod atomic_kind_types.mod cell_types.mod input_section_types.mod distribution_1d_types.mod ewald_environment_types.mod ewald_pw_types.mod fist_energy_types.mod fist_nonbond_env_types.mod multipole_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod message_passing.mod cp_output_handling.mod kinds.mod ewalds_multipole.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="\"Thu Oct 7 17:41:12 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_poisson_types.mod particle_types.mod atomic_kind_types.mod cell_types.mod input_section_types.mod distribution_1d_types.mod ewald_environment_types.mod ewald_pw_types.mod fist_energy_types.mod fist_nonbond_env_types.mod multipole_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod message_passing.mod cp_output_handling.mod kinds.mod ewalds_multipole.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 particle_types.mod atomic_kind_types.mod cell_types.mod cp_para_types.mod fist_nonbond_env_types.mod pair_potential_types.mod base_hooks.mod cp_log_handling.mod bibliography.mod kinds.mod physcon.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="\"Thu Oct 7 17:41:14 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod cp_para_types.mod fist_nonbond_env_types.mod pair_potential_types.mod base_hooks.mod cp_log_handling.mod bibliography.mod kinds.mod physcon.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 cell_types.mod fist_nonbond_env_types.mod pair_potential_types.mod fist_neighbor_list_types.mod base_hooks.mod mathlib.mod mathconstants.mod kinds.mod util.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="\"Thu Oct 7 17:41:14 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cell_types.mod fist_nonbond_env_types.mod pair_potential_types.mod fist_neighbor_list_types.mod base_hooks.mod mathlib.mod mathconstants.mod kinds.mod util.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 particle_types.mod cell_types.mod cp_para_types.mod fist_nonbond_env_types.mod pair_potential_types.mod fist_neighbor_list_types.mod base_hooks.mod mathlib.mod message_passing.mod bibliography.mod kinds.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="\"Thu Oct 7 17:41:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod cell_types.mod cp_para_types.mod fist_nonbond_env_types.mod pair_potential_types.mod fist_neighbor_list_types.mod base_hooks.mod mathlib.mod message_passing.mod bibliography.mod kinds.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 particle_types.mod atomic_kind_types.mod cell_types.mod cp_para_types.mod input_section_types.mod fist_nonbond_env_types.mod pair_potential_types.mod fist_neighbor_list_types.mod base_hooks.mod mathlib.mod cp_log_handling.mod message_passing.mod cp_output_handling.mod kinds.mod util.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="\"Thu Oct 7 17:41:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod cp_para_types.mod input_section_types.mod fist_nonbond_env_types.mod pair_potential_types.mod fist_neighbor_list_types.mod base_hooks.mod mathlib.mod cp_log_handling.mod message_passing.mod cp_output_handling.mod kinds.mod util.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 particle_types.mod atomic_kind_types.mod cell_types.mod cp_para_types.mod input_section_types.mod fist_nonbond_env_types.mod pair_potential_types.mod fist_neighbor_list_types.mod base_hooks.mod mathlib.mod cp_log_handling.mod message_passing.mod cp_output_handling.mod kinds.mod util.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="\"Thu Oct 7 17:41:19 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod cp_para_types.mod input_section_types.mod fist_nonbond_env_types.mod pair_potential_types.mod fist_neighbor_list_types.mod base_hooks.mod mathlib.mod cp_log_handling.mod message_passing.mod cp_output_handling.mod kinds.mod util.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 particle_types.mod atomic_kind_types.mod cell_types.mod fist_neighbor_list_types.mod cp_para_types.mod distribution_1d_types.mod fist_nonbond_env_types.mod input_section_types.mod pair_potential_types.mod base_hooks.mod kinds.mod util.mod message_passing.mod manybody_quip.mod manybody_tersoff.mod manybody_eam.mod manybody_gal.mod manybody_siepmann.mod mathlib.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="\"Thu Oct 7 17:41:20 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod fist_neighbor_list_types.mod cp_para_types.mod distribution_1d_types.mod fist_nonbond_env_types.mod input_section_types.mod pair_potential_types.mod base_hooks.mod kinds.mod util.mod message_passing.mod manybody_quip.mod manybody_tersoff.mod manybody_eam.mod manybody_gal.mod manybody_siepmann.mod mathlib.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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod structure_factor_types.mod cell_types.mod pw_grid_types.mod shell_potential_types.mod distribution_1d_types.mod ewald_environment_types.mod ewald_pw_types.mod dg_rho0_types.mod pw_poisson_types.mod dg_types.mod base_hooks.mod structure_factors.mod kinds.mod message_passing.mod bibliography.mod mathconstants.mod mathlib.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="\"Thu Oct 7 17:41:26 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod structure_factor_types.mod cell_types.mod pw_grid_types.mod shell_potential_types.mod distribution_1d_types.mod ewald_environment_types.mod ewald_pw_types.mod dg_rho0_types.mod pw_poisson_types.mod dg_types.mod base_hooks.mod structure_factors.mod kinds.mod message_passing.mod bibliography.mod mathconstants.mod mathlib.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 particle_types.mod atomic_kind_types.mod cell_types.mod fist_efield_types.mod fist_environment_types.mod input_section_types.mod cp_result_types.mod base_hooks.mod mathconstants.mod moments_utils.mod kinds.mod cp_result_methods.mod physcon.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="\"Thu Oct 7 17:41:27 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod fist_efield_types.mod fist_environment_types.mod input_section_types.mod cp_result_types.mod base_hooks.mod mathconstants.mod moments_utils.mod kinds.mod cp_result_methods.mod physcon.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="\"Thu Oct 7 17:41:30 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod molecule_kind_types.mod atprop_types.mod molecule_types.mod cell_types.mod distribution_1d_types.mod base_hooks.mod mol_force.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/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="\"Thu Oct 7 17:41:32 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod molecule_kind_types.mod atprop_types.mod molecule_types.mod cell_types.mod distribution_1d_types.mod base_hooks.mod mol_force.mod cp_log_handling.mod kinds.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 particle_types.mod atomic_kind_types.mod cell_types.mod fist_neighbor_list_types.mod splines_types.mod atprop_types.mod shell_potential_types.mod distribution_1d_types.mod ewald_environment_types.mod fist_nonbond_env_types.mod pair_potential_types.mod base_hooks.mod pair_potential_coulomb.mod kinds.mod cp_log_handling.mod message_passing.mod splines_methods.mod mathconstants.mod mathlib.mod machine.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="\"Thu Oct 7 17:41:36 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod fist_neighbor_list_types.mod splines_types.mod atprop_types.mod shell_potential_types.mod distribution_1d_types.mod ewald_environment_types.mod fist_nonbond_env_types.mod pair_potential_types.mod base_hooks.mod pair_potential_coulomb.mod kinds.mod cp_log_handling.mod message_passing.mod splines_methods.mod mathconstants.mod mathlib.mod machine.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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod multipole_types.mod exclusion_types.mod cp_para_types.mod fist_energy_types.mod molecule_kind_types.mod virial_types.mod atprop_types.mod shell_potential_types.mod fist_efield_types.mod fist_environment_types.mod distribution_1d_types.mod ewald_environment_types.mod ewald_pw_types.mod cp_subsys_types.mod fist_nonbond_env_types.mod pw_poisson_types.mod input_section_types.mod base_hooks.mod kinds.mod pme.mod fist_pol_scf.mod fist_neighbor_list_control.mod manybody_potential.mod input_constants.mod cp_log_handling.mod message_passing.mod ewalds.mod fist_efield_methods.mod cp_output_handling.mod ewalds_multipole.mod manybody_eam.mod fist_intra_force.mod fist_nonbond_force.mod spme.mod cp_units.mod ewald_pw_methods.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="\"Thu Oct 7 17:41:39 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod multipole_types.mod exclusion_types.mod cp_para_types.mod fist_energy_types.mod molecule_kind_types.mod virial_types.mod atprop_types.mod shell_potential_types.mod fist_efield_types.mod fist_environment_types.mod distribution_1d_types.mod ewald_environment_types.mod ewald_pw_types.mod cp_subsys_types.mod fist_nonbond_env_types.mod pw_poisson_types.mod input_section_types.mod base_hooks.mod kinds.mod pme.mod fist_pol_scf.mod fist_neighbor_list_control.mod manybody_potential.mod input_constants.mod cp_log_handling.mod message_passing.mod ewalds.mod fist_efield_methods.mod cp_output_handling.mod ewalds_multipole.mod manybody_eam.mod fist_intra_force.mod fist_nonbond_force.mod spme.mod cp_units.mod ewald_pw_methods.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod ec_env_types.mod qs_environment_types.mod qs_period_efield_types.mod qs_energy_types.mod qs_force_types.mod base_hooks.mod kinds.mod ai_moments.mod qs_moments.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="\"Thu Oct 7 17:41:44 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod ec_env_types.mod qs_environment_types.mod qs_period_efield_types.mod qs_energy_types.mod qs_force_types.mod base_hooks.mod kinds.mod ai_moments.mod qs_moments.mod orbital_pointers.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 particle_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod xtb_types.mod cp_para_types.mod virial_types.mod atprop_types.mod distribution_1d_types.mod ewald_environment_types.mod ewald_pw_types.mod qs_environment_types.mod pw_poisson_types.mod base_hooks.mod kinds.mod message_passing.mod mathconstants.mod ewald_methods_tb.mod xtb_coulomb.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="\"Thu Oct 7 17:41:47 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod xtb_types.mod cp_para_types.mod virial_types.mod atprop_types.mod distribution_1d_types.mod ewald_environment_types.mod ewald_pw_types.mod qs_environment_types.mod pw_poisson_types.mod base_hooks.mod kinds.mod message_passing.mod mathconstants.mod ewald_methods_tb.mod xtb_coulomb.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 xc_rho_set_types.mod particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod pw_env_types.mod admm_types.mod qs_loc_types.mod qs_kind_types.mod kg_environment_types.mod cp_control_types.mod qs_p_env_types.mod cp_para_types.mod qs_linres_types.mod xtb_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_types.mod qs_kpp1_env_types.mod qs_environment_types.mod pw_poisson_types.mod hfx_types.mod task_list_types.mod input_section_types.mod lri_environment_types.mod qs_mo_types.mod base_hooks.mod string_utilities.mod cp_fm_vect.mod hfx_energy_potential.mod preconditioner.mod qs_vxc_atom.mod cp_fm_struct.mod cp_gemm_interface.mod cp_files.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod qs_collocate_density.mod kg_correction.mod qs_rho0_ggrid.mod hartree_local_methods.mod pw_methods.mod xc_derivatives.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_loc_utils.mod qs_loc_methods.mod qs_integrate_potential.mod pw_poisson_methods.mod lri_ks_methods.mod machine.mod mulliken.mod xtb_ehess.mod qs_rho_methods.mod xc.mod qs_ks_atom.mod cp_external_control.mod cp_dbcsr_operations.mod qs_gapw_densities.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="\"Thu Oct 7 17:41:51 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 xc_rho_set_types.mod particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod pw_env_types.mod admm_types.mod qs_loc_types.mod qs_kind_types.mod kg_environment_types.mod cp_control_types.mod qs_p_env_types.mod cp_para_types.mod qs_linres_types.mod xtb_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_types.mod qs_kpp1_env_types.mod qs_environment_types.mod pw_poisson_types.mod hfx_types.mod task_list_types.mod input_section_types.mod lri_environment_types.mod qs_mo_types.mod base_hooks.mod string_utilities.mod cp_fm_vect.mod hfx_energy_potential.mod preconditioner.mod qs_vxc_atom.mod cp_fm_struct.mod cp_gemm_interface.mod cp_files.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod qs_collocate_density.mod kg_correction.mod qs_rho0_ggrid.mod hartree_local_methods.mod pw_methods.mod xc_derivatives.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_loc_utils.mod qs_loc_methods.mod qs_integrate_potential.mod pw_poisson_methods.mod lri_ks_methods.mod machine.mod mulliken.mod xtb_ehess.mod qs_rho_methods.mod xc.mod qs_ks_atom.mod cp_external_control.mod cp_dbcsr_operations.mod qs_gapw_densities.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 xc_rho_set_types.mod xc_derivative_set_types.mod pw_pool_types.mod pw_types.mod pw_env_types.mod qs_p_env_types.mod cp_para_types.mod qs_rho_types.mod qs_kpp1_env_types.mod qs_environment_types.mod pw_poisson_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod qs_ks_methods.mod qs_vxc_atom.mod kinds.mod input_constants.mod cp_log_handling.mod kahan_sum.mod qs_rho0_ggrid.mod hartree_local_methods.mod pw_methods.mod xc_derivatives.mod cp_output_handling.mod qs_integrate_potential.mod pw_poisson_methods.mod xc.mod qs_ks_atom.mod cp_dbcsr_operations.mod qs_gapw_densities.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="\"Thu Oct 7 17:42:07 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 xc_rho_set_types.mod xc_derivative_set_types.mod pw_pool_types.mod pw_types.mod pw_env_types.mod qs_p_env_types.mod cp_para_types.mod qs_rho_types.mod qs_kpp1_env_types.mod qs_environment_types.mod pw_poisson_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod qs_ks_methods.mod qs_vxc_atom.mod kinds.mod input_constants.mod cp_log_handling.mod kahan_sum.mod qs_rho0_ggrid.mod hartree_local_methods.mod pw_methods.mod xc_derivatives.mod cp_output_handling.mod qs_integrate_potential.mod pw_poisson_methods.mod xc.mod qs_ks_atom.mod cp_dbcsr_operations.mod qs_gapw_densities.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 atomic_kind_types.mod pw_env_types.mod qs_kind_types.mod preconditioner_types.mod hartree_local_types.mod cp_control_types.mod qs_local_rho_types.mod qs_p_env_types.mod cp_fm_pool_types.mod cp_para_types.mod qs_linres_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_types.mod qs_kpp1_env_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod string_utilities.mod cp_fm_vect.mod qs_ks_methods.mod cp_fm_cholesky.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod input_constants.mod cp_log_handling.mod qs_kpp1_env_methods.mod qs_rho_atom_methods.mod qs_rho0_ggrid.mod hartree_local_methods.mod qs_rho0_methods.mod qs_matrix_pools.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_rho_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="\"Thu Oct 7 17:42:13 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 atomic_kind_types.mod pw_env_types.mod qs_kind_types.mod preconditioner_types.mod hartree_local_types.mod cp_control_types.mod qs_local_rho_types.mod qs_p_env_types.mod cp_fm_pool_types.mod cp_para_types.mod qs_linres_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_types.mod qs_kpp1_env_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod string_utilities.mod cp_fm_vect.mod qs_ks_methods.mod cp_fm_cholesky.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod input_constants.mod cp_log_handling.mod qs_kpp1_env_methods.mod qs_rho_atom_methods.mod qs_rho0_ggrid.mod hartree_local_methods.mod qs_rho0_methods.mod qs_matrix_pools.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_rho_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 xc_rho_set_types.mod xc_derivative_set_types.mod particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod admm_types.mod pw_env_types.mod qs_kind_types.mod kg_environment_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_p_env_types.mod cp_para_types.mod pw_grid_types.mod qs_linres_types.mod cp_fm_types.mod qs_ks_types.mod qs_mo_types.mod virial_types.mod qs_rho_types.mod qs_environment_types.mod pw_poisson_types.mod hfx_types.mod input_section_types.mod qs_force_types.mod base_hooks.mod qs_ks_methods.mod hfx_energy_potential.mod qs_linres_methods.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod core_ppnl.mod input_constants.mod cp_log_handling.mod message_passing.mod hfx_derivatives.mod qs_collocate_density.mod kg_correction.mod kg_tnadd_mat.mod qs_vxc.mod cp_dbcsr_cp2k_link.mod qs_overlap.mod pw_methods.mod xc_derivatives.mod qs_kinetic.mod qs_p_env_methods.mod qs_integrate_potential.mod pw_poisson_methods.mod core_ppl.mod xc.mod cp_dbcsr_operations.mod qs_core_energies.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="\"Thu Oct 7 17:42:18 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 xc_rho_set_types.mod xc_derivative_set_types.mod particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod admm_types.mod pw_env_types.mod qs_kind_types.mod kg_environment_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_p_env_types.mod cp_para_types.mod pw_grid_types.mod qs_linres_types.mod cp_fm_types.mod qs_ks_types.mod qs_mo_types.mod virial_types.mod qs_rho_types.mod qs_environment_types.mod pw_poisson_types.mod hfx_types.mod input_section_types.mod qs_force_types.mod base_hooks.mod qs_ks_methods.mod hfx_energy_potential.mod qs_linres_methods.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod core_ppnl.mod input_constants.mod cp_log_handling.mod message_passing.mod hfx_derivatives.mod qs_collocate_density.mod kg_correction.mod kg_tnadd_mat.mod qs_vxc.mod cp_dbcsr_cp2k_link.mod qs_overlap.mod pw_methods.mod xc_derivatives.mod qs_kinetic.mod qs_p_env_methods.mod qs_integrate_potential.mod pw_poisson_methods.mod core_ppl.mod xc.mod cp_dbcsr_operations.mod qs_core_energies.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod basis_set_container_types.mod cp_fm_types.mod kpoint_types.mod qs_environment_types.mod base_hooks.mod qs_interactions.mod lapack.mod cp_fm_struct.mod kinds.mod iterate_matrix.mod input_constants.mod message_passing.mod kpoint_methods.mod cp_dbcsr_cp2k_link.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/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="\"Thu Oct 7 17:42:28 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod basis_set_container_types.mod cp_fm_types.mod kpoint_types.mod qs_environment_types.mod base_hooks.mod qs_interactions.mod lapack.mod cp_fm_struct.mod kinds.mod iterate_matrix.mod input_constants.mod message_passing.mod kpoint_methods.mod cp_dbcsr_cp2k_link.mod cp_fm_diag.mod cp_dbcsr_operations.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 mao_methods.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/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="\"Thu Oct 7 17:42:33 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mao_methods.mod kinds.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 qs_kind_types.mod particle_types.mod basis_set_types.mod cp_control_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod qs_rho_types.mod qs_environment_types.mod qs_ks_types.mod base_hooks.mod qs_neighbor_lists.mod mao_optimizer.mod particle_methods.mod mao_methods.mod kinds.mod cp_dbcsr_operations.mod qs_overlap.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="\"Thu Oct 7 17:42:34 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod basis_set_types.mod cp_control_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod qs_rho_types.mod qs_environment_types.mod qs_ks_types.mod base_hooks.mod qs_neighbor_lists.mod mao_optimizer.mod particle_methods.mod mao_methods.mod kinds.mod cp_dbcsr_operations.mod qs_overlap.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 distribution_2d_types.mod particle_types.mod xc_derivative_set_types.mod xc_rho_set_types.mod basis_set_types.mod atomic_kind_types.mod pw_pool_types.mod molecule_types.mod cell_types.mod pw_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod ec_env_types.mod qs_ks_types.mod qs_mo_types.mod virial_types.mod qs_rho_types.mod distribution_1d_types.mod qs_environment_types.mod external_potential_types.mod pw_poisson_types.mod qs_energy_types.mod task_list_types.mod input_section_types.mod qs_force_types.mod base_hooks.mod qs_neighbor_lists.mod qs_ks_methods.mod cp_fm_cholesky.mod cp_blacs_env.mod cp_fm_struct.mod kinds.mod core_ppnl.mod iterate_matrix.mod input_constants.mod cp_log_handling.mod task_list_methods.mod message_passing.mod qs_collocate_density.mod qs_dispersion_pairpot.mod moments_utils.mod physcon.mod cp_dbcsr_cp2k_link.mod qs_overlap.mod qs_vxc.mod pw_methods.mod xc_derivatives.mod qs_moments.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_kinetic.mod ec_efield_local.mod dm_ls_scf_methods.mod qs_integrate_potential.mod response_solver.mod cp_fm_diag.mod pw_poisson_methods.mod core_ppl.mod xc.mod mao_basis.mod cp_dbcsr_operations.mod qs_core_energies.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="\"Thu Oct 7 17:42:37 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 distribution_2d_types.mod particle_types.mod xc_derivative_set_types.mod xc_rho_set_types.mod basis_set_types.mod atomic_kind_types.mod pw_pool_types.mod molecule_types.mod cell_types.mod pw_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod ec_env_types.mod qs_ks_types.mod qs_mo_types.mod virial_types.mod qs_rho_types.mod distribution_1d_types.mod qs_environment_types.mod external_potential_types.mod pw_poisson_types.mod qs_energy_types.mod task_list_types.mod input_section_types.mod qs_force_types.mod base_hooks.mod qs_neighbor_lists.mod qs_ks_methods.mod cp_fm_cholesky.mod cp_blacs_env.mod cp_fm_struct.mod kinds.mod core_ppnl.mod iterate_matrix.mod input_constants.mod cp_log_handling.mod task_list_methods.mod message_passing.mod qs_collocate_density.mod qs_dispersion_pairpot.mod moments_utils.mod physcon.mod cp_dbcsr_cp2k_link.mod qs_overlap.mod qs_vxc.mod pw_methods.mod xc_derivatives.mod qs_moments.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_kinetic.mod ec_efield_local.mod dm_ls_scf_methods.mod qs_integrate_potential.mod response_solver.mod cp_fm_diag.mod pw_poisson_methods.mod core_ppl.mod xc.mod mao_basis.mod cp_dbcsr_operations.mod qs_core_energies.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 scf_control_types.mod cp_control_types.mod qs_scf_types.mod cp_para_types.mod qs_environment_types.mod base_hooks.mod mathlib.mod input_constants.mod cp_log_handling.mod kinds.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="\"Thu Oct 7 17:42:48 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 scf_control_types.mod cp_control_types.mod qs_scf_types.mod cp_para_types.mod qs_environment_types.mod base_hooks.mod mathlib.mod input_constants.mod cp_log_handling.mod kinds.mod cp_files.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_kind_types.mod particle_types.mod cp_control_types.mod atomic_kind_types.mod cell_types.mod input_section_types.mod qs_loc_types.mod qs_environment_types.mod cp_result_types.mod base_hooks.mod mathconstants.mod cp_log_handling.mod cp_output_handling.mod moments_utils.mod kinds.mod cp_result_methods.mod physcon.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="\"Thu Oct 7 17:42:49 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_kind_types.mod particle_types.mod cp_control_types.mod atomic_kind_types.mod cell_types.mod input_section_types.mod qs_loc_types.mod qs_environment_types.mod cp_result_types.mod base_hooks.mod mathconstants.mod cp_log_handling.mod cp_output_handling.mod moments_utils.mod kinds.mod cp_result_methods.mod physcon.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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qs_loc_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod molecule_kind_types.mod distribution_1d_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod cp_fm_struct.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod moments_utils.mod qs_moments.mod cp_fm_basic_linalg.mod cp_output_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/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="\"Thu Oct 7 17:42:51 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qs_loc_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod molecule_kind_types.mod distribution_1d_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod cp_fm_struct.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod moments_utils.mod qs_moments.mod cp_fm_basic_linalg.mod cp_output_handling.mod orbital_pointers.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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qs_loc_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod molecule_kind_types.mod distribution_1d_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_log_handling.mod message_passing.mod moments_utils.mod physcon.mod mathconstants.mod cp_output_handling.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="\"Thu Oct 7 17:42:54 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qs_loc_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod molecule_kind_types.mod distribution_1d_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_log_handling.mod message_passing.mod moments_utils.mod physcon.mod mathconstants.mod cp_output_handling.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 particle_types.mod molecule_kind_types.mod molecule_types.mod cell_types.mod cp_para_types.mod qs_loc_types.mod distribution_1d_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod memory_utilities.mod kinds.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="\"Thu Oct 7 17:42:56 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod molecule_kind_types.mod molecule_types.mod cell_types.mod cp_para_types.mod qs_loc_types.mod distribution_1d_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod memory_utilities.mod kinds.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_fm_types.mod wannier_states_types.mod cp_para_types.mod input_section_types.mod qs_environment_types.mod base_hooks.mod cp_log_handling.mod cp_units.mod cp_output_handling.mod kinds.mod cp_fm_struct.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/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="\"Thu Oct 7 17:42:57 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_fm_types.mod wannier_states_types.mod cp_para_types.mod input_section_types.mod qs_environment_types.mod base_hooks.mod cp_log_handling.mod cp_units.mod cp_output_handling.mod kinds.mod cp_fm_struct.mod cp_gemm_interface.mod cp_dbcsr_operations.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 particle_types.mod atomic_kind_types.mod pw_types.mod molecule_types.mod cell_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_log_handling.mod message_passing.mod qs_collocate_density.mod bibliography.mod cp_output_handling.mod cp_fm_diag.mod cp_realspace_grid_cube.mod cp_dbcsr_operations.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="\"Thu Oct 7 17:42:59 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_types.mod molecule_types.mod cell_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_log_handling.mod message_passing.mod qs_collocate_density.mod bibliography.mod cp_output_handling.mod cp_fm_diag.mod cp_realspace_grid_cube.mod cp_dbcsr_operations.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 pw_types.mod molecule_types.mod qs_loc_types.mod cp_control_types.mod cp_fm_types.mod wannier_states_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod molecular_moments.mod kinds.mod cp_log_handling.mod molecular_dipoles.mod qs_loc_molecules.mod cp_array_utils.mod cp_output_handling.mod wannier_states.mod molecular_states.mod qs_loc_methods.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="\"Thu Oct 7 17:43:01 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_types.mod molecule_types.mod qs_loc_types.mod cp_control_types.mod cp_fm_types.mod wannier_states_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod molecular_moments.mod kinds.mod cp_log_handling.mod molecular_dipoles.mod qs_loc_molecules.mod cp_array_utils.mod cp_output_handling.mod wannier_states.mod molecular_states.mod qs_loc_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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod qs_subsys_types.mod pw_env_types.mod qs_loc_types.mod qs_kind_types.mod cp_control_types.mod cp_fm_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod cp_fm_vect.mod kinds.mod cp_log_handling.mod qs_loc_dipole.mod cp_array_utils.mod qs_loc_utils.mod qs_loc_states.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="\"Thu Oct 7 17:43:03 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod qs_subsys_types.mod pw_env_types.mod qs_loc_types.mod qs_kind_types.mod cp_control_types.mod cp_fm_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod cp_fm_vect.mod kinds.mod cp_log_handling.mod qs_loc_dipole.mod cp_array_utils.mod qs_loc_utils.mod qs_loc_states.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 qs_kind_types.mod basis_set_types.mod input_section_types.mod qs_environment_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_files.mod cp2k_info.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="\"Thu Oct 7 17:43:06 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod basis_set_types.mod input_section_types.mod qs_environment_types.mod base_hooks.mod cp_log_handling.mod kinds.mod cp_files.mod cp2k_info.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 xas_env_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_atom_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mixing_utils.mod qs_mo_methods.mod string_utilities.mod kinds.mod cp_gemm_interface.mod cp_files.mod cp_log_handling.mod message_passing.mod qs_mo_io.mod cp_output_handling.mod qs_mo_occupation.mod qs_rho_methods.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="\"Thu Oct 7 17:43:07 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 xas_env_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_atom_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mixing_utils.mod qs_mo_methods.mod string_utilities.mod kinds.mod cp_gemm_interface.mod cp_files.mod cp_log_handling.mod message_passing.mod qs_mo_io.mod cp_output_handling.mod qs_mo_occupation.mod qs_rho_methods.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="\"Thu Oct 7 17:43:11 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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="\"Thu Oct 7 17:43:11 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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="\"Thu Oct 7 17:43:13 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_fb_matrix_data_types.mod cp_para_types.mod base_hooks.mod message_passing.mod memory_utilities.mod kinds.mod util.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="\"Thu Oct 7 17:43:13 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_fb_matrix_data_types.mod cp_para_types.mod base_hooks.mod message_passing.mod memory_utilities.mod kinds.mod util.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 qs_fb_matrix_data_types.mod qs_fb_com_tasks_types.mod qs_fb_atomic_halo_types.mod cp_para_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/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="\"Thu Oct 7 17:43:15 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_fb_matrix_data_types.mod qs_fb_com_tasks_types.mod qs_fb_atomic_halo_types.mod cp_para_types.mod base_hooks.mod message_passing.mod kinds.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 qs_fb_matrix_data_types.mod particle_types.mod qs_fb_com_tasks_types.mod qs_fb_atomic_halo_types.mod atomic_kind_types.mod cp_para_types.mod qs_fb_trial_fns_types.mod base_hooks.mod string_utilities.mod message_passing.mod fermi_utils.mod qs_fb_atomic_matrix_methods.mod kinds.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="\"Thu Oct 7 17:43:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_fb_matrix_data_types.mod particle_types.mod qs_fb_com_tasks_types.mod qs_fb_atomic_halo_types.mod atomic_kind_types.mod cp_para_types.mod qs_fb_trial_fns_types.mod base_hooks.mod string_utilities.mod message_passing.mod fermi_utils.mod qs_fb_atomic_matrix_methods.mod kinds.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 particle_types.mod basis_set_types.mod qs_fb_atomic_halo_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_fb_env_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod input_section_types.mod qs_fb_trial_fns_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod string_utilities.mod cp_fm_cholesky.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod qs_fb_filter_matrix_methods.mod qs_matrix_pools.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_mo_occupation.mod orbital_pointers.mod cp_fm_diag.mod qs_diis.mod cp_units.mod qs_integral_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_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="\"Thu Oct 7 17:43:19 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod qs_fb_atomic_halo_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_fb_env_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod input_section_types.mod qs_fb_trial_fns_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod string_utilities.mod cp_fm_cholesky.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod qs_fb_filter_matrix_methods.mod qs_matrix_pools.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_mo_occupation.mod orbital_pointers.mod cp_fm_diag.mod qs_diis.mod cp_units.mod qs_integral_utils.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 qs_kind_types.mod particle_types.mod qs_fb_atomic_halo_types.mod cell_types.mod qs_fb_env_types.mod cp_para_types.mod input_section_types.mod qs_environment_types.mod base_hooks.mod cp_log_handling.mod cp_output_handling.mod kinds.mod util.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="\"Thu Oct 7 17:43:24 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod qs_fb_atomic_halo_types.mod cell_types.mod qs_fb_env_types.mod cp_para_types.mod input_section_types.mod qs_environment_types.mod base_hooks.mod cp_log_handling.mod cp_output_handling.mod kinds.mod util.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 pw_types.mod xas_env_types.mod qs_kind_types.mod cp_control_types.mod qs_cdft_opt_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_atom_types.mod kpoint_types.mod qs_fb_env_types.mod qs_rho_types.mod qs_block_davidson_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod qs_density_mixing_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mixing_utils.mod cp_fm_cholesky.mod cp_fm_struct.mod kinds.mod xas_restart.mod qs_scf_output.mod input_constants.mod cp_log_handling.mod qs_scf_lanczos.mod cp_dbcsr_output.mod qmmm_image_charge.mod qs_outer_scf.mod qs_matrix_pools.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_mo_occupation.mod cp_fm_diag.mod qs_fb_env_methods.mod qs_scf_diagonalization.mod qs_rho_methods.mod qs_initial_guess.mod qs_wf_history_methods.mod cp_dbcsr_operations.mod qs_fb_distribution_methods.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="\"Thu Oct 7 17:43:26 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_types.mod xas_env_types.mod qs_kind_types.mod cp_control_types.mod qs_cdft_opt_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_atom_types.mod kpoint_types.mod qs_fb_env_types.mod qs_rho_types.mod qs_block_davidson_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod qs_density_mixing_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mixing_utils.mod cp_fm_cholesky.mod cp_fm_struct.mod kinds.mod xas_restart.mod qs_scf_output.mod input_constants.mod cp_log_handling.mod qs_scf_lanczos.mod cp_dbcsr_output.mod qmmm_image_charge.mod qs_outer_scf.mod qs_matrix_pools.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_mo_occupation.mod cp_fm_diag.mod qs_fb_env_methods.mod qs_scf_diagonalization.mod qs_rho_methods.mod qs_initial_guess.mod qs_wf_history_methods.mod cp_dbcsr_operations.mod qs_fb_distribution_methods.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 particle_types.mod atomic_kind_types.mod cell_types.mod semi_empirical_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod virial_types.mod atprop_types.mod ewald_environment_types.mod ewald_pw_types.mod qs_environment_types.mod qs_energy_types.mod qs_force_types.mod base_hooks.mod semi_empirical_utils.mod virial_methods.mod kinds.mod input_constants.mod message_passing.mod semi_empirical_int_arrays.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="\"Thu Oct 7 17:43:31 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod semi_empirical_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod virial_types.mod atprop_types.mod ewald_environment_types.mod ewald_pw_types.mod qs_environment_types.mod qs_energy_types.mod qs_force_types.mod base_hooks.mod semi_empirical_utils.mod virial_methods.mod kinds.mod input_constants.mod message_passing.mod semi_empirical_int_arrays.mod semi_empirical_integrals.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 message_passing.mod kinds.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="\"Thu Oct 7 17:43:33 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 message_passing.mod kinds.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 particle_types.mod atomic_kind_types.mod pw_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod pw_grid_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod qs_force_types.mod base_hooks.mod string_utilities.mod kinds.mod cp_log_handling.mod message_passing.mod force_fields_util.mod cp_realspace_grid_cube.mod maxwell_solver_interface.mod fparser.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="\"Thu Oct 7 17:43:34 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod pw_grid_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod qs_force_types.mod base_hooks.mod string_utilities.mod kinds.mod cp_log_handling.mod message_passing.mod force_fields_util.mod cp_realspace_grid_cube.mod maxwell_solver_interface.mod fparser.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 particle_types.mod atomic_kind_types.mod semi_empirical_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_ks_types.mod virial_types.mod qs_rho_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod qs_force_types.mod base_hooks.mod semi_empirical_utils.mod virial_methods.mod kinds.mod input_constants.mod cp_log_handling.mod semi_empirical_int_arrays.mod cp_dbcsr_output.mod physcon.mod qs_overlap.mod cp_output_handling.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="\"Thu Oct 7 17:43:36 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod semi_empirical_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_ks_types.mod virial_types.mod qs_rho_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod qs_force_types.mod base_hooks.mod semi_empirical_utils.mod virial_methods.mod kinds.mod input_constants.mod cp_log_handling.mod semi_empirical_int_arrays.mod cp_dbcsr_output.mod physcon.mod qs_overlap.mod cp_output_handling.mod cp_dbcsr_operations.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 cp_control_types.mod pw_types.mod cell_types.mod qs_rho_types.mod input_section_types.mod pw_env_types.mod realspace_grid_types.mod qs_environment_types.mod base_hooks.mod pw_methods.mod rs_pw_interface.mod message_passing.mod gaussian_gridlevels.mod kinds.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="\"Thu Oct 7 17:43:39 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_control_types.mod pw_types.mod cell_types.mod qs_rho_types.mod input_section_types.mod pw_env_types.mod realspace_grid_types.mod qs_environment_types.mod base_hooks.mod pw_methods.mod rs_pw_interface.mod message_passing.mod gaussian_gridlevels.mod kinds.mod cp_files.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 qs_kind_types.mod particle_types.mod virial_types.mod atprop_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod cell_types.mod cp_para_types.mod qs_force_types.mod qs_environment_types.mod qs_gcp_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod virial_methods.mod ai_overlap.mod kinds.mod physcon.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="\"Thu Oct 7 17:43:41 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod virial_types.mod atprop_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod cell_types.mod cp_para_types.mod qs_force_types.mod qs_environment_types.mod qs_gcp_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod virial_methods.mod ai_overlap.mod kinds.mod physcon.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 particle_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_dftb_types.mod virial_types.mod atprop_types.mod qs_environment_types.mod qs_dispersion_types.mod qs_energy_types.mod qs_force_types.mod base_hooks.mod virial_methods.mod kinds.mod input_constants.mod message_passing.mod qs_dispersion_pairpot.mod qs_dftb_utils.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="\"Thu Oct 7 17:43:44 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_dftb_types.mod virial_types.mod atprop_types.mod qs_environment_types.mod qs_dispersion_types.mod qs_energy_types.mod qs_force_types.mod base_hooks.mod virial_methods.mod kinds.mod input_constants.mod message_passing.mod qs_dispersion_pairpot.mod qs_dftb_utils.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 molecule_types.mod kg_environment_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_ks_types.mod kpoint_types.mod qs_environment_types.mod qs_dispersion_types.mod qs_energy_types.mod input_section_types.mod lri_environment_types.mod qs_gcp_types.mod base_hooks.mod qs_neighbor_lists.mod xtb_matrices.mod qs_ks_methods.mod se_core_core.mod qs_update_s_mstruct.mod kinds.mod optimize_embedding_potential.mod input_constants.mod qs_dispersion_pairpot.mod kpoint_methods.mod ri_environment_methods.mod efield_utils.mod qs_external_potential.mod qs_core_hamiltonian.mod lri_environment_methods.mod se_core_matrix.mod qs_external_density.mod qs_dftb_matrices.mod qs_gcp_method.mod kg_environment.mod qs_dftb_dispersion.mod cp_dbcsr_operations.mod qs_core_energies.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="\"Thu Oct 7 17:43:46 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 molecule_types.mod kg_environment_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_ks_types.mod kpoint_types.mod qs_environment_types.mod qs_dispersion_types.mod qs_energy_types.mod input_section_types.mod lri_environment_types.mod qs_gcp_types.mod base_hooks.mod qs_neighbor_lists.mod xtb_matrices.mod qs_ks_methods.mod se_core_core.mod qs_update_s_mstruct.mod kinds.mod optimize_embedding_potential.mod input_constants.mod qs_dispersion_pairpot.mod kpoint_methods.mod ri_environment_methods.mod efield_utils.mod qs_external_potential.mod qs_core_hamiltonian.mod lri_environment_methods.mod se_core_matrix.mod qs_external_density.mod qs_dftb_matrices.mod qs_gcp_method.mod kg_environment.mod qs_dftb_dispersion.mod cp_dbcsr_operations.mod qs_core_energies.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 qs_scf_types.mod kpoint_types.mod cp_para_types.mod input_section_types.mod cp_subsys_types.mod qs_environment_types.mod base_hooks.mod qs_ks_methods.mod qs_scf_initialization.mod qs_energy_init.mod qs_environment.mod kinds.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="\"Thu Oct 7 17:43:51 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_scf_types.mod kpoint_types.mod cp_para_types.mod input_section_types.mod cp_subsys_types.mod qs_environment_types.mod base_hooks.mod qs_ks_methods.mod qs_scf_initialization.mod qs_energy_init.mod qs_environment.mod kinds.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 cell_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod kpoint_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod string_utilities.mod cp_blacs_env.mod kinds.mod cp_files.mod cp_parser_methods.mod cp_log_handling.mod message_passing.mod kpoint_methods.mod physcon.mod mathconstants.mod qs_matrix_pools.mod cp_para_env.mod qs_gamma2kp.mod machine.mod qs_scf_diagonalization.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="\"Thu Oct 7 17:43:53 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cell_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod kpoint_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod string_utilities.mod cp_blacs_env.mod kinds.mod cp_files.mod cp_parser_methods.mod cp_log_handling.mod message_passing.mod kpoint_methods.mod physcon.mod mathconstants.mod qs_matrix_pools.mod cp_para_env.mod qs_gamma2kp.mod machine.mod qs_scf_diagonalization.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 mathconstants.mod kinds.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="\"Thu Oct 7 17:43:56 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathconstants.mod kinds.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_neighbor_list_types.mod cp_para_types.mod lri_optimize_ri_basis_types.mod qs_rho_types.mod qs_environment_types.mod input_section_types.mod lri_environment_types.mod base_hooks.mod powell.mod kinds.mod generic_os_integrals.mod input_constants.mod cp_log_handling.mod message_passing.mod lri_environment_init.mod memory_utilities.mod cp_output_handling.mod lri_environment_methods.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="\"Thu Oct 7 17:43:57 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_neighbor_list_types.mod cp_para_types.mod lri_optimize_ri_basis_types.mod qs_rho_types.mod qs_environment_types.mod input_section_types.mod lri_environment_types.mod base_hooks.mod powell.mod kinds.mod generic_os_integrals.mod input_constants.mod cp_log_handling.mod message_passing.mod lri_environment_init.mod memory_utilities.mod cp_output_handling.mod lri_environment_methods.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 qs_kind_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod input_section_types.mod cp_fm_types.mod qs_mo_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod mathconstants.mod orbital_transformation_matrices.mod cp_output_handling.mod kinds.mod cp_dbcsr_operations.mod orbital_pointers.mod periodic_table.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="\"Thu Oct 7 17:44:02 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod input_section_types.mod cp_fm_types.mod qs_mo_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod mathconstants.mod orbital_transformation_matrices.mod cp_output_handling.mod kinds.mod cp_dbcsr_operations.mod orbital_pointers.mod periodic_table.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 pw_pool_types.mod pw_types.mod pw_env_types.mod qs_rho_types.mod qs_environment_types.mod qs_ks_types.mod base_hooks.mod pw_methods.mod mathconstants.mod qs_collocate_density.mod kinds.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="\"Thu Oct 7 17:44:04 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_pool_types.mod pw_types.mod pw_env_types.mod qs_rho_types.mod qs_environment_types.mod qs_ks_types.mod base_hooks.mod pw_methods.mod mathconstants.mod qs_collocate_density.mod kinds.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod qs_kind_types.mod preconditioner_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod scf_control_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod orbital_symbols.mod qs_mo_methods.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_log_handling.mod message_passing.mod qs_collocate_density.mod memory_utilities.mod cp_output_handling.mod orbital_pointers.mod cp_fm_diag.mod qs_ot_eigensolver.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="\"Thu Oct 7 17:44:06 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod qs_kind_types.mod preconditioner_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod scf_control_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod orbital_symbols.mod qs_mo_methods.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_log_handling.mod message_passing.mod qs_collocate_density.mod memory_utilities.mod cp_output_handling.mod orbital_pointers.mod cp_fm_diag.mod qs_ot_eigensolver.mod cp_dbcsr_operations.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 pw_pool_types.mod pw_types.mod pw_env_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod cp_fm_struct.mod kinds.mod cp_log_handling.mod qs_collocate_density.mod cp_array_utils.mod cp_fm_basic_linalg.mod cp_output_handling.mod cp_realspace_grid_cube.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="\"Thu Oct 7 17:44:12 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_pool_types.mod pw_types.mod pw_env_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod cp_fm_struct.mod kinds.mod cp_log_handling.mod qs_collocate_density.mod cp_array_utils.mod cp_fm_basic_linalg.mod cp_output_handling.mod cp_realspace_grid_cube.mod cp_dbcsr_operations.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_para_types.mod cp_fm_types.mod qs_rho_types.mod qs_environment_types.mod scf_control_types.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod message_passing.mod cp_dbcsr_output.mod orbital_pointers.mod cp_fm_diag.mod machine.mod particle_methods.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="\"Thu Oct 7 17:44:14 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_para_types.mod cp_fm_types.mod qs_rho_types.mod qs_environment_types.mod scf_control_types.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod message_passing.mod cp_dbcsr_output.mod orbital_pointers.mod cp_fm_diag.mod machine.mod particle_methods.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 qs_neighbor_list_types.mod kpoint_types.mod input_section_types.mod qs_environment_types.mod base_hooks.mod cp_log_handling.mod cp_output_handling.mod kpoint_methods.mod kinds.mod cp_dbcsr_cp2k_link.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="\"Thu Oct 7 17:44:17 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_neighbor_list_types.mod kpoint_types.mod input_section_types.mod qs_environment_types.mod base_hooks.mod cp_log_handling.mod cp_output_handling.mod kpoint_methods.mod kinds.mod cp_dbcsr_cp2k_link.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_kind_types.mod particle_types.mod qs_scf_types.mod input_section_types.mod cp_fm_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod cp_fm_basic_linalg.mod kinds.mod qs_mo_io.mod cp_fm_struct.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="\"Thu Oct 7 17:44:19 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_kind_types.mod particle_types.mod qs_scf_types.mod input_section_types.mod cp_fm_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod cp_fm_basic_linalg.mod kinds.mod qs_mo_io.mod cp_fm_struct.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_control_types.mod kpoint_types.mod cp_para_types.mod input_section_types.mod qs_environment_types.mod qs_mo_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod cp_output_handling.mod kinds.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="\"Thu Oct 7 17:44:21 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_control_types.mod kpoint_types.mod cp_para_types.mod input_section_types.mod qs_environment_types.mod qs_mo_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod cp_output_handling.mod kinds.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 pw_pool_types.mod pw_types.mod qs_subsys_types.mod pw_env_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod iterate_matrix.mod cp_log_handling.mod qs_collocate_density.mod pw_methods.mod cp_fm_basic_linalg.mod cp_output_handling.mod cp_fm_diag.mod cp_realspace_grid_cube.mod cp_dbcsr_operations.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="\"Thu Oct 7 17:44:23 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_pool_types.mod pw_types.mod qs_subsys_types.mod pw_env_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod iterate_matrix.mod cp_log_handling.mod qs_collocate_density.mod pw_methods.mod cp_fm_basic_linalg.mod cp_output_handling.mod cp_fm_diag.mod cp_realspace_grid_cube.mod cp_dbcsr_operations.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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod qs_kind_types.mod preconditioner_types.mod cp_control_types.mod cp_para_types.mod pw_grid_types.mod xtb_types.mod cp_fm_types.mod qs_ks_types.mod qs_dftb_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod pw_poisson_types.mod scf_control_types.mod particle_list_types.mod task_list_types.mod input_section_types.mod cp_result_types.mod qs_mo_types.mod base_hooks.mod molden_utils.mod qs_mo_methods.mod qs_elf_methods.mod qs_pdos.mod stm_images.mod cp_fm_cholesky.mod cp_blacs_env.mod cp_fm_struct.mod kinds.mod population_analyses.mod input_constants.mod cp_log_handling.mod qs_scf_csr_write.mod task_list_methods.mod qs_collocate_density.mod moments_utils.mod qs_mo_io.mod physcon.mod pw_methods.mod qs_scf_wfn_mix.mod mathconstants.mod cp_array_utils.mod memory_utilities.mod cp_output_handling.mod qs_dftb_utils.mod cp_result_methods.mod qs_mo_occupation.mod cp_fm_diag.mod cp_realspace_grid_cube.mod qs_dos.mod qs_ot_eigensolver.mod machine.mod mulliken.mod qs_rho_methods.mod qs_energy_window.mod pw_env_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_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="\"Thu Oct 7 17:44:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod qs_kind_types.mod preconditioner_types.mod cp_control_types.mod cp_para_types.mod pw_grid_types.mod xtb_types.mod cp_fm_types.mod qs_ks_types.mod qs_dftb_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod pw_poisson_types.mod scf_control_types.mod particle_list_types.mod task_list_types.mod input_section_types.mod cp_result_types.mod qs_mo_types.mod base_hooks.mod molden_utils.mod qs_mo_methods.mod qs_elf_methods.mod qs_pdos.mod stm_images.mod cp_fm_cholesky.mod cp_blacs_env.mod cp_fm_struct.mod kinds.mod population_analyses.mod input_constants.mod cp_log_handling.mod qs_scf_csr_write.mod task_list_methods.mod qs_collocate_density.mod moments_utils.mod qs_mo_io.mod physcon.mod pw_methods.mod qs_scf_wfn_mix.mod mathconstants.mod cp_array_utils.mod memory_utilities.mod cp_output_handling.mod qs_dftb_utils.mod cp_result_methods.mod qs_mo_occupation.mod cp_fm_diag.mod cp_realspace_grid_cube.mod qs_dos.mod qs_ot_eigensolver.mod machine.mod mulliken.mod qs_rho_methods.mod qs_energy_window.mod pw_env_methods.mod cp_dbcsr_operations.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: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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod pw_env_types.mod paw_proj_set_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod qs_rho_atom_types.mod qs_rho_types.mod qs_environment_types.mod pw_poisson_types.mod input_section_types.mod base_hooks.mod qs_harmonics_atom.mod qs_ks_methods.mod kinds.mod util.mod cp_log_handling.mod message_passing.mod pw_spline_utils.mod physcon.mod pw_methods.mod mathconstants.mod cp_output_handling.mod orbital_pointers.mod eigenvalueproblems.mod pw_poisson_methods.mod qs_gapw_densities.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="\"Thu Oct 7 17:44:35 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod pw_env_types.mod paw_proj_set_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod qs_rho_atom_types.mod qs_rho_types.mod qs_environment_types.mod pw_poisson_types.mod input_section_types.mod base_hooks.mod qs_harmonics_atom.mod qs_ks_methods.mod kinds.mod util.mod cp_log_handling.mod message_passing.mod pw_spline_utils.mod physcon.mod pw_methods.mod mathconstants.mod cp_output_handling.mod orbital_pointers.mod eigenvalueproblems.mod pw_poisson_methods.mod qs_gapw_densities.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_ks_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod qs_neighbor_lists.mod cp_blacs_env.mod cp_dbcsr_cholesky.mod kinds.mod iterate_matrix.mod message_passing.mod bibliography.mod cp_dbcsr_cp2k_link.mod qs_overlap.mod mao_methods.mod mathlib.mod mao_optimizer.mod particle_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_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="\"Thu Oct 7 17:44:38 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_ks_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod qs_neighbor_lists.mod cp_blacs_env.mod cp_dbcsr_cholesky.mod kinds.mod iterate_matrix.mod message_passing.mod bibliography.mod cp_dbcsr_cp2k_link.mod qs_overlap.mod mao_methods.mod mathlib.mod mao_optimizer.mod particle_methods.mod cp_dbcsr_operations.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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod pw_grid_types.mod qs_rho_atom_types.mod qs_rho_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod qs_harmonics_atom.mod kinds.mod util.mod cp_log_handling.mod message_passing.mod physcon.mod periodic_table.mod pw_methods.mod mathconstants.mod qs_grid_atom.mod cp_output_handling.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="\"Thu Oct 7 17:44:53 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod pw_grid_types.mod qs_rho_atom_types.mod qs_rho_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod qs_harmonics_atom.mod kinds.mod util.mod cp_log_handling.mod message_passing.mod physcon.mod periodic_table.mod pw_methods.mod mathconstants.mod qs_grid_atom.mod cp_output_handling.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 particle_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_environment_types.mod qs_mo_types.mod base_hooks.mod lapack.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_fm_basic_linalg.mod cp_fm_diag.mod particle_methods.mod mao_basis.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="\"Thu Oct 7 17:44:56 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_environment_types.mod qs_mo_types.mod base_hooks.mod lapack.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_fm_basic_linalg.mod cp_fm_diag.mod particle_methods.mod mao_basis.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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod molden_utils.mod qs_mo_methods.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod iterate_matrix.mod minbas_methods.mod cp_log_handling.mod message_passing.mod qs_collocate_density.mod bibliography.mod cp_fm_basic_linalg.mod cp_output_handling.mod atomic_charges.mod cp_realspace_grid_cube.mod mulliken.mod particle_methods.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="\"Thu Oct 7 17:44:59 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod molden_utils.mod qs_mo_methods.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod iterate_matrix.mod minbas_methods.mod cp_log_handling.mod message_passing.mod qs_collocate_density.mod bibliography.mod cp_fm_basic_linalg.mod cp_output_handling.mod atomic_charges.mod cp_realspace_grid_cube.mod mulliken.mod particle_methods.mod cp_dbcsr_operations.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod paw_proj_set_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod qs_rho_atom_types.mod qs_rho_types.mod qs_environment_types.mod base_hooks.mod orbital_transformation_matrices.mod kinds.mod util.mod message_passing.mod pw_grids.mod bibliography.mod physcon.mod pw_methods.mod mathconstants.mod memory_utilities.mod orbital_pointers.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="\"Thu Oct 7 17:45:04 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod paw_proj_set_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod qs_rho_atom_types.mod qs_rho_types.mod qs_environment_types.mod base_hooks.mod orbital_transformation_matrices.mod kinds.mod util.mod message_passing.mod pw_grids.mod bibliography.mod physcon.mod pw_methods.mod mathconstants.mod memory_utilities.mod orbital_pointers.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 qs_kind_types.mod basis_set_types.mod qs_neighbor_list_types.mod base_hooks.mod orbital_pointers.mod ai_contraction.mod qs_integral_utils.mod kinds.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="\"Thu Oct 7 17:45:09 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod basis_set_types.mod qs_neighbor_list_types.mod base_hooks.mod orbital_pointers.mod ai_contraction.mod qs_integral_utils.mod kinds.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_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_environment_types.mod base_hooks.mod commutator_rpnl.mod commutator_rkinetic.mod kinds.mod cp_dbcsr_operations.mod cp_dbcsr_cp2k_link.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="\"Thu Oct 7 17:45:10 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_environment_types.mod base_hooks.mod commutator_rpnl.mod commutator_rkinetic.mod kinds.mod cp_dbcsr_operations.mod cp_dbcsr_cp2k_link.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_subsys_types.mod qs_kind_types.mod cp_control_types.mod cp_fm_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod qs_energy_types.mod input_section_types.mod qs_force_types.mod qs_mo_types.mod base_hooks.mod orbital_symbols.mod orbital_transformation_matrices.mod kinds.mod cp_files.mod cp_log_handling.mod periodic_table.mod cp_output_handling.mod orbital_pointers.mod machine.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="\"Thu Oct 7 17:45:12 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_subsys_types.mod qs_kind_types.mod cp_control_types.mod cp_fm_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod qs_energy_types.mod input_section_types.mod qs_force_types.mod qs_mo_types.mod base_hooks.mod orbital_symbols.mod orbital_transformation_matrices.mod kinds.mod cp_files.mod cp_log_handling.mod periodic_table.mod cp_output_handling.mod orbital_pointers.mod machine.mod cp_dbcsr_operations.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="\"Thu Oct 7 17:45:17 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod kpoint_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_files.mod cp_log_handling.mod message_passing.mod kpoint_methods.mod physcon.mod cp_dbcsr_cp2k_link.mod mathconstants.mod qs_moments.mod qs_matrix_pools.mod wannier90.mod cp_para_env.mod qs_gamma2kp.mod machine.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_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="\"Thu Oct 7 17:45:20 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod kpoint_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_files.mod cp_log_handling.mod message_passing.mod kpoint_methods.mod physcon.mod cp_dbcsr_cp2k_link.mod mathconstants.mod qs_moments.mod qs_matrix_pools.mod wannier90.mod cp_para_env.mod qs_gamma2kp.mod machine.mod qs_scf_diagonalization.mod cp_dbcsr_operations.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod qs_loc_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod pw_grid_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod pw_poisson_types.mod particle_list_types.mod qs_energy_types.mod task_list_types.mod input_section_types.mod qs_active_space_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod cp_fm_vect.mod qs_ks_methods.mod cp_fm_struct.mod cp_gemm_interface.mod cp_files.mod kinds.mod input_constants.mod cp_log_handling.mod task_list_methods.mod message_passing.mod qs_collocate_density.mod periodic_table.mod pw_methods.mod mathconstants.mod memory_utilities.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_loc_utils.mod qs_loc_methods.mod cp_fm_diag.mod cp_realspace_grid_cube.mod pw_poisson_methods.mod pw_env_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_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="\"Thu Oct 7 17:45:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod qs_loc_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod pw_grid_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod pw_poisson_types.mod particle_list_types.mod qs_energy_types.mod task_list_types.mod input_section_types.mod qs_active_space_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod cp_fm_vect.mod qs_ks_methods.mod cp_fm_struct.mod cp_gemm_interface.mod cp_files.mod kinds.mod input_constants.mod cp_log_handling.mod task_list_methods.mod message_passing.mod qs_collocate_density.mod periodic_table.mod pw_methods.mod mathconstants.mod memory_utilities.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_loc_utils.mod qs_loc_methods.mod cp_fm_diag.mod cp_realspace_grid_cube.mod pw_poisson_methods.mod pw_env_methods.mod cp_dbcsr_operations.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="\"Thu Oct 7 17:45:34 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod qs_environment_types.mod pw_poisson_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod kahan_sum.mod uff_vdw_radii_table.mod qs_collocate_density.mod bibliography.mod periodic_table.mod pw_methods.mod mathconstants.mod memory_utilities.mod cp_output_handling.mod atomic_charges.mod cp_realspace_grid_cube.mod pw_poisson_methods.mod machine.mod cp_units.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="\"Thu Oct 7 17:45:34 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod qs_environment_types.mod pw_poisson_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod kahan_sum.mod uff_vdw_radii_table.mod qs_collocate_density.mod bibliography.mod periodic_table.mod pw_methods.mod mathconstants.mod memory_utilities.mod cp_output_handling.mod atomic_charges.mod cp_realspace_grid_cube.mod pw_poisson_methods.mod machine.mod cp_units.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 pw_pool_types.mod pw_types.mod pw_env_types.mod cp_control_types.mod qs_ks_types.mod virial_types.mod qs_rho_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod qs_ks_methods.mod kinds.mod cp_log_handling.mod qs_collocate_density.mod bibliography.mod qs_vxc.mod pw_methods.mod mathlib.mod cp_dbcsr_operations.mod qs_energy_matrix_w.mod qs_core_energies.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="\"Thu Oct 7 17:45:40 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_pool_types.mod pw_types.mod pw_env_types.mod cp_control_types.mod qs_ks_types.mod virial_types.mod qs_rho_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod qs_ks_methods.mod kinds.mod cp_log_handling.mod qs_collocate_density.mod bibliography.mod qs_vxc.mod pw_methods.mod mathlib.mod cp_dbcsr_operations.mod qs_energy_matrix_w.mod qs_core_energies.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 molecule_types.mod qs_rho_types.mod pw_poisson_types.mod qs_energy_types.mod input_section_types.mod basis_set_types.mod qs_subsys_types.mod pw_env_types.mod admm_types.mod cp_para_types.mod hirshfeld_types.mod qs_rho_atom_types.mod kpoint_types.mod atomic_kind_types.mod qs_loc_types.mod preconditioner_types.mod qs_neighbor_list_types.mod et_coupling_types.mod cp_fm_types.mod qs_ks_types.mod qs_mo_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod particle_types.mod pw_pool_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_rho0_types.mod virial_types.mod ps_implicit_types.mod particle_list_types.mod base_hooks.mod qs_mo_methods.mod qs_ks_methods.mod hirshfeld_methods.mod cp_fm_struct.mod qs_mo_io.mod qs_electric_field_gradient.mod physcon.mod mao_wfn_analysis.mod qs_scf_wfn_mix.mod mathconstants.mod qs_moments.mod ai_onecenter.mod cp_output_handling.mod orbital_pointers.mod cp_fm_diag.mod cp_realspace_grid_cube.mod mulliken.mod qs_integral_utils.mod cp_ddapc_util.mod cp_dbcsr_operations.mod molden_utils.mod lapack.mod qs_elf_methods.mod cp_fm_vect.mod transport.mod qs_epr_hyp.mod minbas_wfn_analysis.mod qs_scf_csr_write.mod message_passing.mod cp_dbcsr_output.mod xray_diffraction.mod qs_commutators.mod qs_loc_utils.mod qs_chargemol.mod qs_loc_states.mod pw_poisson_methods.mod voronoi_interface.mod admm_utils.mod qs_wannier90.mod qs_energy_window.mod qs_core_energies.mod stm_images.mod cp_blacs_env.mod input_constants.mod cp_log_handling.mod pw_grids.mod qs_collocate_density.mod pw_methods.mod cp_array_utils.mod memory_utilities.mod s_square_methods.mod qs_mo_occupation.mod qs_dos.mod qs_ot_eigensolver.mod qs_pdos.mod kinds.mod population_analyses.mod qs_active_space_methods.mod qs_resp.mod qs_loc_dipole.mod qs_grid_atom.mod qs_local_properties.mod dct.mod atom_kind_orbitals.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="\"Thu Oct 7 17:45:42 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 molecule_types.mod qs_rho_types.mod pw_poisson_types.mod qs_energy_types.mod input_section_types.mod basis_set_types.mod qs_subsys_types.mod pw_env_types.mod admm_types.mod cp_para_types.mod hirshfeld_types.mod qs_rho_atom_types.mod kpoint_types.mod atomic_kind_types.mod qs_loc_types.mod preconditioner_types.mod qs_neighbor_list_types.mod et_coupling_types.mod cp_fm_types.mod qs_ks_types.mod qs_mo_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod particle_types.mod pw_pool_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_rho0_types.mod virial_types.mod ps_implicit_types.mod particle_list_types.mod base_hooks.mod qs_mo_methods.mod qs_ks_methods.mod hirshfeld_methods.mod cp_fm_struct.mod qs_mo_io.mod qs_electric_field_gradient.mod physcon.mod mao_wfn_analysis.mod qs_scf_wfn_mix.mod mathconstants.mod qs_moments.mod ai_onecenter.mod cp_output_handling.mod orbital_pointers.mod cp_fm_diag.mod cp_realspace_grid_cube.mod mulliken.mod qs_integral_utils.mod cp_ddapc_util.mod cp_dbcsr_operations.mod molden_utils.mod lapack.mod qs_elf_methods.mod cp_fm_vect.mod transport.mod qs_epr_hyp.mod minbas_wfn_analysis.mod qs_scf_csr_write.mod message_passing.mod cp_dbcsr_output.mod xray_diffraction.mod qs_commutators.mod qs_loc_utils.mod qs_chargemol.mod qs_loc_states.mod pw_poisson_methods.mod voronoi_interface.mod admm_utils.mod qs_wannier90.mod qs_energy_window.mod qs_core_energies.mod stm_images.mod cp_blacs_env.mod input_constants.mod cp_log_handling.mod pw_grids.mod qs_collocate_density.mod pw_methods.mod cp_array_utils.mod memory_utilities.mod s_square_methods.mod qs_mo_occupation.mod qs_dos.mod qs_ot_eigensolver.mod qs_pdos.mod kinds.mod population_analyses.mod qs_active_space_methods.mod qs_resp.mod qs_loc_dipole.mod qs_grid_atom.mod qs_local_properties.mod dct.mod atom_kind_orbitals.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_subsys_types.mod semi_empirical_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod cp_result_types.mod qs_mo_types.mod base_hooks.mod qs_ks_methods.mod kinds.mod cp_log_handling.mod message_passing.mod ai_moments.mod moments_utils.mod qs_mo_io.mod cp_dbcsr_output.mod physcon.mod mathconstants.mod cp_output_handling.mod cp_result_methods.mod orbital_pointers.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="\"Thu Oct 7 17:45:58 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_subsys_types.mod semi_empirical_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod cp_result_types.mod qs_mo_types.mod base_hooks.mod qs_ks_methods.mod kinds.mod cp_log_handling.mod message_passing.mod ai_moments.mod moments_utils.mod qs_mo_io.mod cp_dbcsr_output.mod physcon.mod mathconstants.mod cp_output_handling.mod cp_result_methods.mod orbital_pointers.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 cp_control_types.mod qs_scf_types.mod input_section_types.mod qs_environment_types.mod base_hooks.mod localization_tb.mod basis_set_output.mod qs_band_structure.mod lri_optimize_ri_basis.mod qs_scf_post_tb.mod qs_scf_post_gpw.mod qs_scf_post_se.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="\"Thu Oct 7 17:46:03 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_control_types.mod qs_scf_types.mod input_section_types.mod qs_environment_types.mod base_hooks.mod localization_tb.mod basis_set_output.mod qs_band_structure.mod lri_optimize_ri_basis.mod qs_scf_post_tb.mod qs_scf_post_gpw.mod qs_scf_post_se.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 scf_control_types.mod qs_ot_types.mod input_section_types.mod cp_fm_types.mod qs_mo_types.mod base_hooks.mod qs_ot_minimizer.mod cp_log_handling.mod qs_ot.mod cp_array_utils.mod cp_output_handling.mod kinds.mod qs_mo_occupation.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_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="\"Thu Oct 7 17:46:05 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 scf_control_types.mod qs_ot_types.mod input_section_types.mod cp_fm_types.mod qs_mo_types.mod base_hooks.mod qs_ot_minimizer.mod cp_log_handling.mod qs_ot.mod cp_array_utils.mod cp_output_handling.mod kinds.mod qs_mo_occupation.mod cp_dbcsr_operations.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 cp_control_types.mod cp_para_types.mod qs_ks_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod qs_density_mixing_types.mod qs_energy_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mixing_utils.mod qs_mo_methods.mod qs_mom_methods.mod kinds.mod qs_ot_scf.mod qs_scf_output.mod qs_scf_methods.mod cp_log_handling.mod qs_outer_scf.mod qs_gspace_mixing.mod qs_mo_occupation.mod qs_fb_env_methods.mod qs_scf_diagonalization.mod qs_rho_methods.mod cp_external_control.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="\"Thu Oct 7 17:46:07 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_control_types.mod cp_para_types.mod qs_ks_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod qs_density_mixing_types.mod qs_energy_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mixing_utils.mod qs_mo_methods.mod qs_mom_methods.mod kinds.mod qs_ot_scf.mod qs_scf_output.mod qs_scf_methods.mod cp_log_handling.mod qs_outer_scf.mod qs_gspace_mixing.mod qs_mo_occupation.mod qs_fb_env_methods.mod qs_scf_diagonalization.mod qs_rho_methods.mod cp_external_control.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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_cdft_types.mod kpoint_types.mod qs_rho_types.mod qs_block_davidson_types.mod qs_charges_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod qs_density_mixing_types.mod qs_energy_types.mod input_section_types.mod cp_result_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod qs_cdft_scf_utils.mod qs_ks_methods.mod qs_scf_post_scf.mod preconditioner.mod kinds.mod cp_files.mod qs_ot_scf.mod qs_scf_output.mod input_constants.mod cp_log_handling.mod qs_ot.mod kpoint_io.mod message_passing.mod qs_mo_io.mod qs_scf_initialization.mod qs_outer_scf.mod qs_scf_loop_utils.mod cp_output_handling.mod cp_result_methods.mod qs_integrate_potential.mod qs_mo_occupation.mod mathlib.mod machine.mod qs_diis.mod qs_rho_methods.mod qs_wf_history_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.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="\"Thu Oct 7 17:46:11 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_cdft_types.mod kpoint_types.mod qs_rho_types.mod qs_block_davidson_types.mod qs_charges_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod qs_density_mixing_types.mod qs_energy_types.mod input_section_types.mod cp_result_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod qs_cdft_scf_utils.mod qs_ks_methods.mod qs_scf_post_scf.mod preconditioner.mod kinds.mod cp_files.mod qs_ot_scf.mod qs_scf_output.mod input_constants.mod cp_log_handling.mod qs_ot.mod kpoint_io.mod message_passing.mod qs_mo_io.mod qs_scf_initialization.mod qs_outer_scf.mod qs_scf_loop_utils.mod cp_output_handling.mod cp_result_methods.mod qs_integrate_potential.mod qs_mo_occupation.mod mathlib.mod machine.mod qs_diis.mod qs_rho_methods.mod qs_wf_history_methods.mod cp_dbcsr_operations.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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod almo_scf_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod qs_energy_types.mod qs_mo_types.mod base_hooks.mod qs_ks_methods.mod cp_fm_struct.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod cp_dbcsr_cp2k_link.mod cp_units.mod qs_rho_methods.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="\"Thu Oct 7 17:46:19 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod almo_scf_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod qs_energy_types.mod qs_mo_types.mod base_hooks.mod qs_ks_methods.mod cp_fm_struct.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod cp_dbcsr_cp2k_link.mod cp_units.mod qs_rho_methods.mod cp_dbcsr_operations.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 cp_log_handling.mod message_passing.mod kinds.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="\"Thu Oct 7 17:46:24 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_log_handling.mod message_passing.mod kinds.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 mathlib.mod input_constants.mod cp_log_handling.mod iterate_matrix.mod domain_submatrix_methods.mod fermi_utils.mod cp_blacs_env.mod cp_dbcsr_cholesky.mod bibliography.mod kinds.mod util.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="\"Thu Oct 7 17:46:28 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathlib.mod input_constants.mod cp_log_handling.mod iterate_matrix.mod domain_submatrix_methods.mod fermi_utils.mod cp_blacs_env.mod cp_dbcsr_cholesky.mod bibliography.mod kinds.mod util.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 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/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="\"Thu Oct 7 17:46:37 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 base_hooks.mod cp_log_handling.mod kinds.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 input_constants.mod cp_blacs_env.mod kinds.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="\"Thu Oct 7 17:46:38 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_constants.mod cp_blacs_env.mod kinds.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 cp_log_handling.mod domain_submatrix_methods.mod kinds.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="\"Thu Oct 7 17:46:39 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_log_handling.mod domain_submatrix_methods.mod kinds.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 input_constants.mod cp_log_handling.mod machine.mod cp_dbcsr_cholesky.mod kinds.mod cp_dbcsr_diag.mod iterate_matrix.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="\"Thu Oct 7 17:46:40 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_constants.mod cp_log_handling.mod machine.mod cp_dbcsr_cholesky.mod kinds.mod cp_dbcsr_diag.mod iterate_matrix.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 particle_types.mod cell_types.mod almo_scf_lbfgs_types.mod qs_kind_types.mod almo_scf_types.mod ct_types.mod cp_para_types.mod domain_submatrix_types.mod almo_scf_diis_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod cp_blacs_env.mod cp_dbcsr_cholesky.mod kinds.mod cp_files.mod almo_scf_qs.mod iterate_matrix.mod qs_localization_methods.mod input_constants.mod cp_log_handling.mod message_passing.mod almo_scf_methods.mod cp_output_handling.mod qs_loc_utils.mod ct_methods.mod machine.mod domain_submatrix_methods.mod particle_methods.mod cp_external_control.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="\"Thu Oct 7 17:46:44 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod cell_types.mod almo_scf_lbfgs_types.mod qs_kind_types.mod almo_scf_types.mod ct_types.mod cp_para_types.mod domain_submatrix_types.mod almo_scf_diis_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod cp_blacs_env.mod cp_dbcsr_cholesky.mod kinds.mod cp_files.mod almo_scf_qs.mod iterate_matrix.mod qs_localization_methods.mod input_constants.mod cp_log_handling.mod message_passing.mod almo_scf_methods.mod cp_output_handling.mod qs_loc_utils.mod ct_methods.mod machine.mod domain_submatrix_methods.mod particle_methods.mod cp_external_control.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 mscfg_types.mod particle_types.mod atomic_kind_types.mod molecule_types.mod qs_kind_types.mod almo_scf_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_scf_post_scf.mod cp_blacs_env.mod kinds.mod almo_scf_qs.mod iterate_matrix.mod input_constants.mod cp_log_handling.mod message_passing.mod bibliography.mod almo_scf_methods.mod cp_dbcsr_diag.mod cp_para_env.mod mathlib.mod domain_submatrix_methods.mod almo_scf_optimizer.mod qs_initial_guess.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="\"Thu Oct 7 17:47:10 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mscfg_types.mod particle_types.mod atomic_kind_types.mod molecule_types.mod qs_kind_types.mod almo_scf_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_scf_post_scf.mod cp_blacs_env.mod kinds.mod almo_scf_qs.mod iterate_matrix.mod input_constants.mod cp_log_handling.mod message_passing.mod bibliography.mod almo_scf_methods.mod cp_dbcsr_diag.mod cp_para_env.mod mathlib.mod domain_submatrix_methods.mod almo_scf_optimizer.mod qs_initial_guess.mod cp_dbcsr_operations.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 input_section_types.mod qs_environment_types.mod base_hooks.mod machine.mod cp_log_handling.mod mathconstants.mod dm_ls_scf_qs.mod cp_output_handling.mod arnoldi_api.mod kinds.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="\"Thu Oct 7 17:47:23 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_section_types.mod qs_environment_types.mod base_hooks.mod machine.mod cp_log_handling.mod mathconstants.mod dm_ls_scf_qs.mod cp_output_handling.mod arnoldi_api.mod kinds.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 mathlib.mod input_constants.mod cp_log_handling.mod machine.mod mathconstants.mod bibliography.mod kinds.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_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="\"Thu Oct 7 17:47:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathlib.mod input_constants.mod cp_log_handling.mod machine.mod mathconstants.mod bibliography.mod kinds.mod iterate_matrix.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 molecule_types.mod cp_control_types.mod transport_env_types.mod qs_ks_types.mod qs_diis_types.mod qs_environment_types.mod dm_ls_scf_types.mod input_section_types.mod base_hooks.mod arnoldi_api.mod transport.mod kinds.mod qs_scf_post_tb.mod iterate_matrix.mod input_constants.mod cp_log_handling.mod bibliography.mod pao_main.mod qs_scf_post_gpw.mod dm_ls_scf_qs.mod dm_ls_chebyshev.mod dm_ls_scf_methods.mod mathlib.mod machine.mod qs_diis.mod dm_ls_scf_curvy.mod cp_external_control.mod pexsi_methods.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="\"Thu Oct 7 17:47:28 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 molecule_types.mod cp_control_types.mod transport_env_types.mod qs_ks_types.mod qs_diis_types.mod qs_environment_types.mod dm_ls_scf_types.mod input_section_types.mod base_hooks.mod arnoldi_api.mod transport.mod kinds.mod qs_scf_post_tb.mod iterate_matrix.mod input_constants.mod cp_log_handling.mod bibliography.mod pao_main.mod qs_scf_post_gpw.mod dm_ls_scf_qs.mod dm_ls_chebyshev.mod dm_ls_scf_methods.mod mathlib.mod machine.mod qs_diis.mod dm_ls_scf_curvy.mod cp_external_control.mod pexsi_methods.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 particle_types.mod atomic_kind_types.mod cell_types.mod qs_loc_types.mod xas_env_types.mod qs_kind_types.mod preconditioner_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_types.mod qs_charges_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod qs_density_mixing_types.mod qs_energy_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mixing_utils.mod qs_mo_methods.mod qs_ks_methods.mod preconditioner.mod cp_blacs_env.mod xas_control.mod kinds.mod xas_restart.mod qs_scf_output.mod qs_scf_methods.mod input_constants.mod cp_log_handling.mod message_passing.mod qs_scf_initialization.mod qs_scf.mod cp_array_utils.mod cp_output_handling.mod qs_gspace_mixing.mod qs_loc_methods.mod qs_mo_occupation.mod qs_ot_eigensolver.mod machine.mod qs_scf_diagonalization.mod particle_methods.mod qs_rho_methods.mod cp_external_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="\"Thu Oct 7 17:47:34 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod qs_loc_types.mod xas_env_types.mod qs_kind_types.mod preconditioner_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_types.mod qs_charges_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod qs_density_mixing_types.mod qs_energy_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mixing_utils.mod qs_mo_methods.mod qs_ks_methods.mod preconditioner.mod cp_blacs_env.mod xas_control.mod kinds.mod xas_restart.mod qs_scf_output.mod qs_scf_methods.mod input_constants.mod cp_log_handling.mod message_passing.mod qs_scf_initialization.mod qs_scf.mod cp_array_utils.mod cp_output_handling.mod qs_gspace_mixing.mod qs_loc_methods.mod qs_mo_occupation.mod qs_ot_eigensolver.mod machine.mod qs_scf_diagonalization.mod particle_methods.mod qs_rho_methods.mod cp_external_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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_loc_types.mod xas_env_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod qs_pdos.mod ai_overlap.mod xas_control.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod xas_restart.mod input_constants.mod cp_log_handling.mod ai_contraction.mod qs_operators_ao.mod xas_tp_scf.mod qs_mo_io.mod qs_scf_initialization.mod physcon.mod cp_dbcsr_cp2k_link.mod periodic_table.mod qs_matrix_pools.mod qs_scf.mod cp_array_utils.mod memory_utilities.mod cp_output_handling.mod qs_loc_utils.mod qs_loc_methods.mod orbital_pointers.mod qs_diis.mod particle_methods.mod cp_external_control.mod cp_dbcsr_operations.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="\"Thu Oct 7 17:47:40 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_loc_types.mod xas_env_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod qs_pdos.mod ai_overlap.mod xas_control.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod xas_restart.mod input_constants.mod cp_log_handling.mod ai_contraction.mod qs_operators_ao.mod xas_tp_scf.mod qs_mo_io.mod qs_scf_initialization.mod physcon.mod cp_dbcsr_cp2k_link.mod periodic_table.mod qs_matrix_pools.mod qs_scf.mod cp_array_utils.mod memory_utilities.mod cp_output_handling.mod qs_loc_utils.mod qs_loc_methods.mod orbital_pointers.mod qs_diis.mod particle_methods.mod cp_external_control.mod cp_dbcsr_operations.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod kpoint_types.mod qs_environment_types.mod scf_control_types.mod particle_list_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_log_handling.mod qs_collocate_density.mod bibliography.mod physcon.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_mo_occupation.mod orbital_pointers.mod cp_fm_diag.mod cp_realspace_grid_cube.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="\"Thu Oct 7 17:47:48 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod kpoint_types.mod qs_environment_types.mod scf_control_types.mod particle_list_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_log_handling.mod qs_collocate_density.mod bibliography.mod physcon.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_mo_occupation.mod orbital_pointers.mod cp_fm_diag.mod cp_realspace_grid_cube.mod cp_dbcsr_operations.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 message_passing.mod base_hooks.mod util.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="\"Thu Oct 7 17:47:54 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 message_passing.mod base_hooks.mod util.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 pw_types.mod mp2_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod hfx_energy_potential.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod message_passing.mod qs_ks_utils.mod qs_vxc.mod cp_dbcsr_cp2k_link.mod cp_fm_basic_linalg.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/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="\"Thu Oct 7 17:47:54 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_types.mod mp2_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod hfx_energy_potential.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod message_passing.mod qs_ks_utils.mod qs_vxc.mod cp_dbcsr_cp2k_link.mod cp_fm_basic_linalg.mod cp_fm_diag.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 mp2_types.mod group_dist_types.mod cp_fm_types.mod cp_para_types.mod base_hooks.mod message_passing.mod kinds.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod cp_dbcsr_operations.mod util.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="\"Thu Oct 7 17:47:58 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mp2_types.mod group_dist_types.mod cp_fm_types.mod cp_para_types.mod base_hooks.mod message_passing.mod kinds.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod cp_dbcsr_operations.mod util.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 mp2_types.mod group_dist_types.mod cp_para_types.mod base_hooks.mod mp2_ri_grad_util.mod machine.mod message_passing.mod kinds.mod cp_para_env.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="\"Thu Oct 7 17:48:05 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mp2_types.mod group_dist_types.mod cp_para_types.mod base_hooks.mod mp2_ri_grad_util.mod machine.mod message_passing.mod kinds.mod cp_para_env.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 mp2_types.mod group_dist_types.mod cp_para_types.mod cp_fm_types.mod base_hooks.mod mp2_ri_grad_util.mod message_passing.mod kinds.mod cp_blacs_env.mod cp_fm_struct.mod cp_dbcsr_operations.mod util.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="\"Thu Oct 7 17:48:38 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mp2_types.mod group_dist_types.mod cp_para_types.mod cp_fm_types.mod base_hooks.mod mp2_ri_grad_util.mod message_passing.mod kinds.mod cp_blacs_env.mod cp_fm_struct.mod cp_dbcsr_operations.mod util.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 qs_kind_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod kpoint_types.mod base_hooks.mod mathconstants.mod generic_shg_integrals.mod generic_shg_integrals_init.mod kinds.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="\"Thu Oct 7 17:48:41 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod kpoint_types.mod base_hooks.mod mathconstants.mod generic_shg_integrals.mod generic_shg_integrals_init.mod kinds.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_environment_types.mod pw_poisson_types.mod task_list_types.mod base_hooks.mod ao_util.mod kinds.mod input_constants.mod task_list_methods.mod message_passing.mod qs_collocate_density.mod gaussian_gridlevels.mod rs_pw_interface.mod pw_methods.mod qs_integrate_potential.mod orbital_pointers.mod pw_poisson_methods.mod pw_env_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="\"Thu Oct 7 17:48:44 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_environment_types.mod pw_poisson_types.mod task_list_types.mod base_hooks.mod ao_util.mod kinds.mod input_constants.mod task_list_methods.mod message_passing.mod qs_collocate_density.mod gaussian_gridlevels.mod rs_pw_interface.mod pw_methods.mod qs_integrate_potential.mod orbital_pointers.mod pw_poisson_methods.mod pw_env_methods.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_environment_types.mod eri_mme_types.mod input_section_types.mod base_hooks.mod cp_eri_mme_interface.mod kinds.mod util.mod input_constants.mod message_passing.mod ai_contraction_sphi.mod eri_mme_integrate.mod ai_coulomb.mod orbital_pointers.mod eri_mme_test.mod qs_integral_utils.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="\"Thu Oct 7 17:48:47 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_environment_types.mod eri_mme_types.mod input_section_types.mod base_hooks.mod cp_eri_mme_interface.mod kinds.mod util.mod input_constants.mod message_passing.mod ai_contraction_sphi.mod eri_mme_integrate.mod ai_coulomb.mod orbital_pointers.mod eri_mme_test.mod qs_integral_utils.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 cp_cfm_types.mod distribution_2d_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod mp2_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod group_dist_types.mod kpoint_types.mod qs_environment_types.mod base_hooks.mod qs_interactions.mod libint_2c_3c.mod cp_fm_cholesky.mod cp_eri_mme_interface.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod cp_cfm_basic_linalg.mod kinds.mod rpa_communication.mod input_constants.mod kpoint_coulomb_2c.mod message_passing.mod kpoint_methods.mod cp_dbcsr_cp2k_link.mod qs_tensors.mod cp_fm_basic_linalg.mod cp_para_env.mod cp_fm_diag.mod mp2_eri_gpw.mod qs_integral_utils.mod particle_methods.mod constants_operator.mod mp2_eri.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_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="\"Thu Oct 7 17:49:22 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_cfm_types.mod distribution_2d_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod mp2_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod group_dist_types.mod kpoint_types.mod qs_environment_types.mod base_hooks.mod qs_interactions.mod libint_2c_3c.mod cp_fm_cholesky.mod cp_eri_mme_interface.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod cp_cfm_basic_linalg.mod kinds.mod rpa_communication.mod input_constants.mod kpoint_coulomb_2c.mod message_passing.mod kpoint_methods.mod cp_dbcsr_cp2k_link.mod qs_tensors.mod cp_fm_basic_linalg.mod cp_para_env.mod cp_fm_diag.mod mp2_eri_gpw.mod qs_integral_utils.mod particle_methods.mod constants_operator.mod mp2_eri.mod cp_dbcsr_operations.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod group_dist_types.mod kpoint_types.mod qs_environment_types.mod pw_poisson_types.mod hfx_types.mod task_list_types.mod qs_tensors_types.mod base_hooks.mod libint_2c_3c.mod cp_eri_mme_interface.mod cp_blacs_env.mod cp_fm_struct.mod kinds.mod util.mod input_constants.mod message_passing.mod kpoint_methods.mod bibliography.mod qs_tensors.mod mp2_ri_2c.mod cp_para_env.mod mp2_eri_gpw.mod machine.mod cp_units.mod qs_integral_utils.mod particle_methods.mod mp2_eri.mod cp_dbcsr_operations.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="\"Thu Oct 7 17:49:28 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod group_dist_types.mod kpoint_types.mod qs_environment_types.mod pw_poisson_types.mod hfx_types.mod task_list_types.mod qs_tensors_types.mod base_hooks.mod libint_2c_3c.mod cp_eri_mme_interface.mod cp_blacs_env.mod cp_fm_struct.mod kinds.mod util.mod input_constants.mod message_passing.mod kpoint_methods.mod bibliography.mod qs_tensors.mod mp2_ri_2c.mod cp_para_env.mod mp2_eri_gpw.mod machine.mod cp_units.mod qs_integral_utils.mod particle_methods.mod mp2_eri.mod cp_dbcsr_operations.mod 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 atomic_kind_types.mod pw_pool_types.mod pw_types.mod pw_env_types.mod mp2_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod virial_types.mod qs_rho_types.mod qs_environment_types.mod pw_poisson_types.mod hfx_types.mod qs_energy_types.mod input_section_types.mod qs_force_types.mod base_hooks.mod hfx_energy_potential.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod linear_systems.mod message_passing.mod kahan_sum.mod qs_collocate_density.mod cp_dbcsr_cp2k_link.mod pw_methods.mod mathconstants.mod cp_fm_basic_linalg.mod qs_integrate_potential.mod mp2_eri_gpw.mod pw_poisson_methods.mod machine.mod qs_rho_methods.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="\"Thu Oct 7 17:49:42 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 atomic_kind_types.mod pw_pool_types.mod pw_types.mod pw_env_types.mod mp2_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod virial_types.mod qs_rho_types.mod qs_environment_types.mod pw_poisson_types.mod hfx_types.mod qs_energy_types.mod input_section_types.mod qs_force_types.mod base_hooks.mod hfx_energy_potential.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod linear_systems.mod message_passing.mod kahan_sum.mod qs_collocate_density.mod cp_dbcsr_cp2k_link.mod pw_methods.mod mathconstants.mod cp_fm_basic_linalg.mod qs_integrate_potential.mod mp2_eri_gpw.mod pw_poisson_methods.mod machine.mod qs_rho_methods.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 mp2_types.mod group_dist_types.mod cp_fm_types.mod cp_para_types.mod base_hooks.mod message_passing.mod cp_fm_cholesky.mod cp_fm_basic_linalg.mod kinds.mod cp_gemm_interface.mod rpa_communication.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="\"Thu Oct 7 17:49:54 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mp2_types.mod group_dist_types.mod cp_fm_types.mod cp_para_types.mod base_hooks.mod message_passing.mod cp_fm_cholesky.mod cp_fm_basic_linalg.mod kinds.mod cp_gemm_interface.mod rpa_communication.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="\"Thu Oct 7 17:49:57 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:49:58 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 mp2_types.mod cp_fm_types.mod kpoint_types.mod cp_para_types.mod qs_environment_types.mod qs_mo_types.mod base_hooks.mod machine.mod mathconstants.mod message_passing.mod minimax_exp_gw.mod kinds.mod minimax_exp.mod minimax_rpa.mod cp_para_env.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="\"Thu Oct 7 17:50:01 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mp2_types.mod cp_fm_types.mod kpoint_types.mod cp_para_types.mod qs_environment_types.mod qs_mo_types.mod base_hooks.mod machine.mod mathconstants.mod message_passing.mod minimax_exp_gw.mod kinds.mod minimax_exp.mod minimax_rpa.mod cp_para_env.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 cell_types.mod mp2_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod kpoint_types.mod qs_environment_types.mod hfx_types.mod qs_tensors_types.mod qs_mo_types.mod base_hooks.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod message_passing.mod qs_tensors.mod mathconstants.mod cp_fm_basic_linalg.mod machine.mod cp_dbcsr_operations.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="\"Thu Oct 7 17:50:06 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cell_types.mod mp2_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod kpoint_types.mod qs_environment_types.mod hfx_types.mod qs_tensors_types.mod qs_mo_types.mod base_hooks.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod message_passing.mod qs_tensors.mod mathconstants.mod cp_fm_basic_linalg.mod machine.mod cp_dbcsr_operations.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 cp_cfm_types.mod particle_types.mod basis_set_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod cp_fm_types.mod kpoint_types.mod qs_environment_types.mod base_hooks.mod kinds.mod cp_cfm_basic_linalg.mod message_passing.mod rpa_im_time.mod mathconstants.mod cp_fm_basic_linalg.mod mathlib.mod qs_integral_utils.mod particle_methods.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="\"Thu Oct 7 17:50:14 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_cfm_types.mod particle_types.mod basis_set_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod cp_fm_types.mod kpoint_types.mod qs_environment_types.mod base_hooks.mod kinds.mod cp_cfm_basic_linalg.mod message_passing.mod rpa_im_time.mod mathconstants.mod cp_fm_basic_linalg.mod mathlib.mod qs_integral_utils.mod particle_methods.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_cfm_types.mod particle_types.mod cell_types.mod cp_para_types.mod kpoint_types.mod qs_environment_types.mod cp_fm_types.mod base_hooks.mod mathconstants.mod rpa_gw_kpoints.mod message_passing.mod kinds.mod cp_cfm_basic_linalg.mod cp_dbcsr_operations.mod rpa_im_time.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="\"Thu Oct 7 17:50:17 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_cfm_types.mod particle_types.mod cell_types.mod cp_para_types.mod kpoint_types.mod qs_environment_types.mod cp_fm_types.mod base_hooks.mod mathconstants.mod rpa_gw_kpoints.mod message_passing.mod kinds.mod cp_cfm_basic_linalg.mod cp_dbcsr_operations.mod rpa_im_time.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 particle_types.mod atomic_kind_types.mod cell_types.mod qs_subsys_types.mod qs_kind_types.mod mp2_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod hfx_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod hfx_energy_potential.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod rpa_communication.mod util.mod cp_fm_basic_linalg.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/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="\"Thu Oct 7 17:50:19 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod qs_subsys_types.mod qs_kind_types.mod mp2_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod hfx_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod hfx_energy_potential.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod rpa_communication.mod util.mod cp_fm_basic_linalg.mod cp_fm_diag.mod cp_dbcsr_operations.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 kinds.mod base_hooks.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="\"Thu Oct 7 17:50:23 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 kinds.mod base_hooks.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 cp_cfm_types.mod cell_types.mod mp2_types.mod cp_para_types.mod cp_fm_types.mod kpoint_types.mod qs_environment_types.mod hfx_types.mod base_hooks.mod cp_fm_cholesky.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod rpa_communication.mod input_constants.mod message_passing.mod mathconstants.mod cp_fm_basic_linalg.mod cp_para_env.mod machine.mod rpa_gw_kpoints.mod mp2_laplace.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="\"Thu Oct 7 17:50:23 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_cfm_types.mod cell_types.mod mp2_types.mod cp_para_types.mod cp_fm_types.mod kpoint_types.mod qs_environment_types.mod hfx_types.mod base_hooks.mod cp_fm_cholesky.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod rpa_communication.mod input_constants.mod message_passing.mod mathconstants.mod cp_fm_basic_linalg.mod cp_para_env.mod machine.mod rpa_gw_kpoints.mod mp2_laplace.mod cp_dbcsr_operations.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod mp2_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod hfx_types.mod qs_tensors_types.mod base_hooks.mod kinds.mod rpa_communication.mod message_passing.mod qs_tensors.mod qs_integral_utils.mod particle_methods.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_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="\"Thu Oct 7 17:50:27 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod mp2_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod hfx_types.mod qs_tensors_types.mod base_hooks.mod kinds.mod rpa_communication.mod message_passing.mod qs_tensors.mod qs_integral_utils.mod particle_methods.mod cp_dbcsr_operations.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 cp_cfm_types.mod particle_types.mod basis_set_types.mod cell_types.mod qs_kind_types.mod mp2_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod kpoint_types.mod qs_environment_types.mod hfx_types.mod qs_tensors_types.mod qs_mo_types.mod base_hooks.mod qs_neighbor_lists.mod cp_fm_cholesky.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_files.mod input_constants.mod qs_band_structure.mod message_passing.mod physcon.mod qs_overlap.mod qs_tensors.mod rpa_gw_im_time_util.mod mathconstants.mod qs_moments.mod cp_fm_basic_linalg.mod cp_fm_diag.mod qs_gamma2kp.mod qs_integral_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_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="\"Thu Oct 7 17:50:33 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_cfm_types.mod particle_types.mod basis_set_types.mod cell_types.mod qs_kind_types.mod mp2_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod kpoint_types.mod qs_environment_types.mod hfx_types.mod qs_tensors_types.mod qs_mo_types.mod base_hooks.mod qs_neighbor_lists.mod cp_fm_cholesky.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_files.mod input_constants.mod qs_band_structure.mod message_passing.mod physcon.mod qs_overlap.mod qs_tensors.mod rpa_gw_im_time_util.mod mathconstants.mod qs_moments.mod cp_fm_basic_linalg.mod cp_fm_diag.mod qs_gamma2kp.mod qs_integral_utils.mod cp_dbcsr_operations.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 mp2_types.mod cp_para_types.mod qs_tensors_types.mod cp_fm_types.mod base_hooks.mod message_passing.mod kinds.mod cp_dbcsr_operations.mod rpa_communication.mod physcon.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="\"Thu Oct 7 17:50:50 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mp2_types.mod cp_para_types.mod qs_tensors_types.mod cp_fm_types.mod base_hooks.mod message_passing.mod kinds.mod cp_dbcsr_operations.mod rpa_communication.mod physcon.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 cp_cfm_types.mod mp2_types.mod cp_para_types.mod cp_fm_types.mod group_dist_types.mod kpoint_types.mod qs_environment_types.mod hfx_types.mod base_hooks.mod mp2_ri_grad_util.mod bse.mod cp_blacs_env.mod cp_fm_struct.mod kinds.mod rpa_communication.mod util.mod input_constants.mod message_passing.mod bibliography.mod minimax_exp.mod mp2_grids.mod rpa_im_time.mod mathconstants.mod cp_fm_basic_linalg.mod rpa_kpoints.mod rpa_axk.mod cp_para_env.mod rpa_util.mod machine.mod rpa_gw.mod mp2_laplace.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="\"Thu Oct 7 17:50:52 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_cfm_types.mod mp2_types.mod cp_para_types.mod cp_fm_types.mod group_dist_types.mod kpoint_types.mod qs_environment_types.mod hfx_types.mod base_hooks.mod mp2_ri_grad_util.mod bse.mod cp_blacs_env.mod cp_fm_struct.mod kinds.mod rpa_communication.mod util.mod input_constants.mod message_passing.mod bibliography.mod minimax_exp.mod mp2_grids.mod rpa_im_time.mod mathconstants.mod cp_fm_basic_linalg.mod rpa_kpoints.mod rpa_axk.mod cp_para_env.mod rpa_util.mod machine.mod rpa_gw.mod mp2_laplace.mod rpa_gw_ic.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod mp2_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod virial_types.mod qs_environment_types.mod pw_poisson_types.mod task_list_types.mod qs_force_types.mod base_hooks.mod ao_util.mod cp_eri_mme_interface.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod util.mod input_constants.mod message_passing.mod qs_collocate_density.mod gaussian_gridlevels.mod rs_pw_interface.mod pw_methods.mod mathconstants.mod qs_integrate_potential.mod orbital_pointers.mod cp_para_env.mod mp2_eri_gpw.mod pw_poisson_methods.mod mp2_eri.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="\"Thu Oct 7 17:51:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod mp2_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod virial_types.mod qs_environment_types.mod pw_poisson_types.mod task_list_types.mod qs_force_types.mod base_hooks.mod ao_util.mod cp_eri_mme_interface.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod util.mod input_constants.mod message_passing.mod qs_collocate_density.mod gaussian_gridlevels.mod rs_pw_interface.mod pw_methods.mod mathconstants.mod qs_integrate_potential.mod orbital_pointers.mod cp_para_env.mod mp2_eri_gpw.mod pw_poisson_methods.mod mp2_eri.mod cp_dbcsr_operations.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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod group_dist_types.mod qs_environment_types.mod pw_poisson_types.mod task_list_types.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod kinds.mod message_passing.mod qs_collocate_density.mod qs_integrate_potential.mod cp_para_env.mod mp2_eri_gpw.mod machine.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="\"Thu Oct 7 17:51:11 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod group_dist_types.mod qs_environment_types.mod pw_poisson_types.mod task_list_types.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod kinds.mod message_passing.mod qs_collocate_density.mod qs_integrate_potential.mod cp_para_env.mod mp2_eri_gpw.mod machine.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 distribution_2d_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qs_kind_types.mod mp2_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod molecule_kind_types.mod group_dist_types.mod kpoint_types.mod distribution_1d_types.mod qs_environment_types.mod hfx_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_interactions.mod qs_neighbor_lists.mod rpa_rse.mod mp2_ri_gpw.mod cp_blacs_env.mod distribution_methods.mod cp_fm_struct.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod cp_dbcsr_cp2k_link.mod mp2_integrals.mod mp2_cphf.mod cp_para_env.mod machine.mod rpa_main.mod qs_integral_utils.mod libint_wrapper.mod particle_methods.mod mp2_ri_grad.mod cp_dbcsr_operations.mod mp2_gpw_method.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="\"Thu Oct 7 17:51:17 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 distribution_2d_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qs_kind_types.mod mp2_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod molecule_kind_types.mod group_dist_types.mod kpoint_types.mod distribution_1d_types.mod qs_environment_types.mod hfx_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_interactions.mod qs_neighbor_lists.mod rpa_rse.mod mp2_ri_gpw.mod cp_blacs_env.mod distribution_methods.mod cp_fm_struct.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod cp_dbcsr_cp2k_link.mod mp2_integrals.mod mp2_cphf.mod cp_para_env.mod machine.mod rpa_main.mod qs_integral_utils.mod libint_wrapper.mod particle_methods.mod mp2_ri_grad.mod cp_dbcsr_operations.mod mp2_gpw_method.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod mp2_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod hfx_types.mod base_hooks.mod hfx_energy_potential.mod cp_fm_cholesky.mod hfx_pair_list_methods.mod cp_blacs_env.mod cp_fm_struct.mod gamma.mod cp_files.mod kinds.mod t_sh_p_s_c.mod input_constants.mod message_passing.mod hfx_screening_methods.mod cp_fm_basic_linalg.mod orbital_pointers.mod cp_fm_diag.mod libint_wrapper.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="\"Thu Oct 7 17:51:24 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod mp2_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod hfx_types.mod base_hooks.mod hfx_energy_potential.mod cp_fm_cholesky.mod hfx_pair_list_methods.mod cp_blacs_env.mod cp_fm_struct.mod gamma.mod cp_files.mod kinds.mod t_sh_p_s_c.mod input_constants.mod message_passing.mod hfx_screening_methods.mod cp_fm_basic_linalg.mod orbital_pointers.mod cp_fm_diag.mod libint_wrapper.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 particle_types.mod cell_types.mod mp2_types.mod cp_para_types.mod qs_environment_types.mod hfx_types.mod base_hooks.mod hfx_energy_potential.mod hfx_load_balance_methods.mod hfx_pair_list_methods.mod kinds.mod t_sh_p_s_c.mod input_constants.mod cp_log_handling.mod message_passing.mod mathconstants.mod mp2_ri_libint.mod orbital_pointers.mod libint_wrapper.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="\"Thu Oct 7 17:51:33 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod cell_types.mod mp2_types.mod cp_para_types.mod qs_environment_types.mod hfx_types.mod base_hooks.mod hfx_energy_potential.mod hfx_load_balance_methods.mod hfx_pair_list_methods.mod kinds.mod t_sh_p_s_c.mod input_constants.mod cp_log_handling.mod message_passing.mod mathconstants.mod mp2_ri_libint.mod orbital_pointers.mod libint_wrapper.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 basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod mp2_types.mod cp_para_types.mod basis_set_container_types.mod qs_environment_types.mod hfx_types.mod base_hooks.mod orbital_symbols.mod kinds.mod util.mod mp2_direct_method.mod cp_log_handling.mod message_passing.mod memory_utilities.mod mp2_ri_libint.mod orbital_pointers.mod cp_para_env.mod machine.mod libint_wrapper.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="\"Thu Oct 7 17:51:44 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod mp2_types.mod cp_para_types.mod basis_set_container_types.mod qs_environment_types.mod hfx_types.mod base_hooks.mod orbital_symbols.mod kinds.mod util.mod mp2_direct_method.mod cp_log_handling.mod message_passing.mod memory_utilities.mod mp2_ri_libint.mod orbital_pointers.mod cp_para_env.mod machine.mod libint_wrapper.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 cp_cfm_types.mod particle_types.mod atomic_kind_types.mod admm_types.mod qs_kind_types.mod mp2_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod virial_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod hfx_types.mod qs_energy_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_ks_methods.mod hfx_energy_potential.mod cp_fm_cholesky.mod mp2_gpw.mod cp_blacs_env.mod cp_fm_struct.mod cp_cfm_basic_linalg.mod cp_files.mod kinds.mod qs_scf_methods.mod mp2_direct_method.mod input_constants.mod cp_log_handling.mod message_passing.mod kpoint_methods.mod bibliography.mod physcon.mod cp_dbcsr_cp2k_link.mod mathconstants.mod qs_matrix_pools.mod admm_methods.mod cp_fm_basic_linalg.mod cp_output_handling.mod cp_para_env.mod cp_fm_diag.mod machine.mod mp2_optimize_ri_basis.mod 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/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="\"Thu Oct 7 17:51:54 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_cfm_types.mod particle_types.mod atomic_kind_types.mod admm_types.mod qs_kind_types.mod mp2_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod virial_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod scf_control_types.mod hfx_types.mod qs_energy_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_ks_methods.mod hfx_energy_potential.mod cp_fm_cholesky.mod mp2_gpw.mod cp_blacs_env.mod cp_fm_struct.mod cp_cfm_basic_linalg.mod cp_files.mod kinds.mod qs_scf_methods.mod mp2_direct_method.mod input_constants.mod cp_log_handling.mod message_passing.mod kpoint_methods.mod bibliography.mod physcon.mod cp_dbcsr_cp2k_link.mod mathconstants.mod qs_matrix_pools.mod admm_methods.mod cp_fm_basic_linalg.mod cp_output_handling.mod cp_para_env.mod cp_fm_diag.mod machine.mod mp2_optimize_ri_basis.mod admm_utils.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 distribution_2d_types.mod qs_loc_types.mod qs_ot_types.mod cp_para_types.mod cp_fm_types.mod input_section_types.mod base_hooks.mod libint_2c_3c.mod qs_harmonics_atom.mod kinds.mod cp_files.mod input_constants.mod physcon.mod cp_array_utils.mod memory_utilities.mod qs_grid_atom.mod cp_para_env.mod mathlib.mod libint_wrapper.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="\"Thu Oct 7 17:52:02 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 distribution_2d_types.mod qs_loc_types.mod qs_ot_types.mod cp_para_types.mod cp_fm_types.mod input_section_types.mod base_hooks.mod libint_2c_3c.mod qs_harmonics_atom.mod kinds.mod cp_files.mod input_constants.mod physcon.mod cp_array_utils.mod memory_utilities.mod qs_grid_atom.mod cp_para_env.mod mathlib.mod libint_wrapper.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 distribution_2d_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qs_kind_types.mod xas_tdp_types.mod qs_neighbor_list_types.mod cp_para_types.mod distribution_1d_types.mod qs_environment_types.mod eri_mme_types.mod input_section_types.mod qs_o3c_types.mod base_hooks.mod qs_neighbor_lists.mod libint_2c_3c.mod cp_eri_mme_interface.mod cp_blacs_env.mod gamma.mod cp_files.mod generic_os_integrals.mod kinds.mod input_constants.mod message_passing.mod t_c_g0.mod ai_contraction_sphi.mod cp_array_utils.mod eri_mme_integrate.mod orbital_pointers.mod mathlib.mod qs_integral_utils.mod libint_wrapper.mod particle_methods.mod constants_operator.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_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="\"Thu Oct 7 17:52:04 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 distribution_2d_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod qs_kind_types.mod xas_tdp_types.mod qs_neighbor_list_types.mod cp_para_types.mod distribution_1d_types.mod qs_environment_types.mod eri_mme_types.mod input_section_types.mod qs_o3c_types.mod base_hooks.mod qs_neighbor_lists.mod libint_2c_3c.mod cp_eri_mme_interface.mod cp_blacs_env.mod gamma.mod cp_files.mod generic_os_integrals.mod kinds.mod input_constants.mod message_passing.mod t_c_g0.mod ai_contraction_sphi.mod cp_array_utils.mod eri_mme_integrate.mod orbital_pointers.mod mathlib.mod qs_integral_utils.mod libint_wrapper.mod particle_methods.mod constants_operator.mod cp_dbcsr_operations.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 xc_rho_set_types.mod xc_derivative_set_types.mod particle_types.mod basis_set_types.mod cell_types.mod qs_kind_types.mod xas_tdp_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod xc_derivative_types.mod qs_rho_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod orbital_transformation_matrices.mod libint_2c_3c.mod qs_harmonics_atom.mod cp_blacs_env.mod cp_dbcsr_cholesky.mod kinds.mod util.mod input_constants.mod cp_log_handling.mod message_passing.mod xas_tdp_integrals.mod atom_operators.mod spherical_harmonics.mod physcon.mod qs_overlap.mod lebedev.mod mathconstants.mod xc_derivatives.mod ai_contraction_sphi.mod cp_array_utils.mod memory_utilities.mod qs_grid_atom.mod xc_atom.mod orbital_pointers.mod cp_para_env.mod mathlib.mod qs_integral_utils.mod particle_methods.mod xc.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="\"Thu Oct 7 17:52:13 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 xc_rho_set_types.mod xc_derivative_set_types.mod particle_types.mod basis_set_types.mod cell_types.mod qs_kind_types.mod xas_tdp_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod xc_derivative_types.mod qs_rho_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod orbital_transformation_matrices.mod libint_2c_3c.mod qs_harmonics_atom.mod cp_blacs_env.mod cp_dbcsr_cholesky.mod kinds.mod util.mod input_constants.mod cp_log_handling.mod message_passing.mod xas_tdp_integrals.mod atom_operators.mod spherical_harmonics.mod physcon.mod qs_overlap.mod lebedev.mod mathconstants.mod xc_derivatives.mod ai_contraction_sphi.mod cp_array_utils.mod memory_utilities.mod qs_grid_atom.mod xc_atom.mod orbital_pointers.mod cp_para_env.mod mathlib.mod qs_integral_utils.mod particle_methods.mod xc.mod cp_dbcsr_operations.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 qs_kind_types.mod distribution_2d_types.mod particle_types.mod xas_tdp_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod base_hooks.mod message_passing.mod qs_integral_utils.mod particle_methods.mod kinds.mod cp_dbcsr_operations.mod util.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="\"Thu Oct 7 17:52:31 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod distribution_2d_types.mod particle_types.mod xas_tdp_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod base_hooks.mod message_passing.mod qs_integral_utils.mod particle_methods.mod kinds.mod cp_dbcsr_operations.mod util.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 cp_cfm_types.mod admm_types.mod xas_tdp_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod hfx_admm_utils.mod cp_cfm_diag.mod qs_ks_methods.mod xas_tdp_kernel.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod util.mod cp_log_handling.mod message_passing.mod bibliography.mod physcon.mod cp_array_utils.mod cp_fm_diag.mod machine.mod 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/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="\"Thu Oct 7 17:52:35 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_cfm_types.mod admm_types.mod xas_tdp_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod hfx_admm_utils.mod cp_cfm_diag.mod qs_ks_methods.mod xas_tdp_kernel.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod util.mod cp_log_handling.mod message_passing.mod bibliography.mod physcon.mod cp_array_utils.mod cp_fm_diag.mod machine.mod admm_utils.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_cfm_types.mod preconditioner_types.mod xas_tdp_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod cp_cfm_diag.mod xas_tdp_kernel.mod cp_blacs_env.mod cp_dbcsr_cholesky.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_cfm_basic_linalg.mod input_constants.mod cp_log_handling.mod physcon.mod cp_fm_basic_linalg.mod cp_dbcsr_diag.mod cp_fm_diag.mod qs_ot_eigensolver.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/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="\"Thu Oct 7 17:52:48 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_cfm_types.mod preconditioner_types.mod xas_tdp_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod cp_cfm_diag.mod xas_tdp_kernel.mod cp_blacs_env.mod cp_dbcsr_cholesky.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_cfm_basic_linalg.mod input_constants.mod cp_log_handling.mod physcon.mod cp_fm_basic_linalg.mod cp_dbcsr_diag.mod cp_fm_diag.mod qs_ot_eigensolver.mod mathlib.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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod admm_types.mod qs_loc_types.mod qs_kind_types.mod cp_control_types.mod xas_tdp_types.mod cp_para_types.mod cp_fm_types.mod parallel_rng_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod input_section_types.mod qs_mo_types.mod xc_write_output.mod qs_interactions.mod base_hooks.mod qs_mo_methods.mod xas_tdp_atom.mod qs_pdos.mod xas_methods.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod cp_files.mod kinds.mod util.mod input_constants.mod cp_log_handling.mod xas_tdp_correction.mod message_passing.mod xas_tdp_integrals.mod qs_operators_ao.mod physcon.mod periodic_table.mod xas_tdp_utils.mod memory_utilities.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_loc_utils.mod qs_loc_methods.mod cp_fm_diag.mod mathlib.mod machine.mod input_cp2k_dft.mod libint_wrapper.mod admm_utils.mod particle_methods.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="\"Thu Oct 7 17:52:58 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod basis_set_types.mod atomic_kind_types.mod cell_types.mod admm_types.mod qs_loc_types.mod qs_kind_types.mod cp_control_types.mod xas_tdp_types.mod cp_para_types.mod cp_fm_types.mod parallel_rng_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod input_section_types.mod qs_mo_types.mod xc_write_output.mod qs_interactions.mod base_hooks.mod qs_mo_methods.mod xas_tdp_atom.mod qs_pdos.mod xas_methods.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod cp_files.mod kinds.mod util.mod input_constants.mod cp_log_handling.mod xas_tdp_correction.mod message_passing.mod xas_tdp_integrals.mod qs_operators_ao.mod physcon.mod periodic_table.mod xas_tdp_utils.mod memory_utilities.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_loc_utils.mod qs_loc_methods.mod cp_fm_diag.mod mathlib.mod machine.mod input_cp2k_dft.mod libint_wrapper.mod admm_utils.mod particle_methods.mod cp_dbcsr_operations.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 qs_kind_types.mod basis_set_types.mod cp_control_types.mod atomic_kind_types.mod qs_environment_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="\"Thu Oct 7 17:53:10 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod basis_set_types.mod cp_control_types.mod atomic_kind_types.mod qs_environment_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 distribution_2d_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod admm_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod molecule_kind_types.mod distribution_1d_types.mod qs_environment_types.mod task_list_types.mod input_section_types.mod base_hooks.mod qs_neighbor_lists.mod cp_blacs_env.mod distribution_methods.mod cp_fm_struct.mod kinds.mod input_constants.mod task_list_methods.mod message_passing.mod cp_dbcsr_cp2k_link.mod cp_para_env.mod pw_env_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_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="\"Thu Oct 7 17:53:12 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 distribution_2d_types.mod particle_types.mod basis_set_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod admm_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod molecule_kind_types.mod distribution_1d_types.mod qs_environment_types.mod task_list_types.mod input_section_types.mod base_hooks.mod qs_neighbor_lists.mod cp_blacs_env.mod distribution_methods.mod cp_fm_struct.mod kinds.mod input_constants.mod task_list_methods.mod message_passing.mod cp_dbcsr_cp2k_link.mod cp_para_env.mod pw_env_methods.mod cp_dbcsr_operations.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 xc_rho_set_types.mod xc_derivative_set_types.mod qs_tddfpt2_stda_types.mod pw_pool_types.mod pw_types.mod admm_types.mod pw_env_types.mod qs_neighbor_list_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod qs_rho_types.mod ewald_environment_types.mod ewald_pw_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod cp_fm_vect.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod qs_tddfpt2_subgroups.mod xc_derivatives.mod qs_rho_methods.mod xc.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="\"Thu Oct 7 17:53:15 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 xc_rho_set_types.mod xc_derivative_set_types.mod qs_tddfpt2_stda_types.mod pw_pool_types.mod pw_types.mod admm_types.mod pw_env_types.mod qs_neighbor_list_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod qs_rho_types.mod ewald_environment_types.mod ewald_pw_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod cp_fm_vect.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod qs_tddfpt2_subgroups.mod xc_derivatives.mod qs_rho_methods.mod xc.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 cp_fm_types.mod pw_types.mod qs_rho_types.mod qs_environment_types.mod qs_ks_types.mod qs_tddfpt2_subgroups.mod base_hooks.mod kinds.mod qs_collocate_density.mod qs_rho_methods.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_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="\"Thu Oct 7 17:53:18 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_fm_types.mod pw_types.mod qs_rho_types.mod qs_environment_types.mod qs_ks_types.mod qs_tddfpt2_subgroups.mod base_hooks.mod kinds.mod qs_collocate_density.mod qs_rho_methods.mod cp_gemm_interface.mod cp_dbcsr_operations.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 cp_cfm_types.mod particle_types.mod qs_tddfpt2_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod pw_poisson_types.mod particle_list_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod molden_utils.mod string_utilities.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod dbcsr_vector.mod cp_cfm_basic_linalg.mod kinds.mod util.mod input_constants.mod cp_log_handling.mod message_passing.mod kahan_sum.mod qs_operators_ao.mod qs_collocate_density.mod bibliography.mod moments_utils.mod physcon.mod mathconstants.mod qs_moments.mod cp_fm_basic_linalg.mod cp_output_handling.mod cp_fm_diag.mod cp_realspace_grid_cube.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="\"Thu Oct 7 17:53:19 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_cfm_types.mod particle_types.mod qs_tddfpt2_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod pw_poisson_types.mod particle_list_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod molden_utils.mod string_utilities.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod dbcsr_vector.mod cp_cfm_basic_linalg.mod kinds.mod util.mod input_constants.mod cp_log_handling.mod message_passing.mod kahan_sum.mod qs_operators_ao.mod qs_collocate_density.mod bibliography.mod moments_utils.mod physcon.mod mathconstants.mod qs_moments.mod cp_fm_basic_linalg.mod cp_output_handling.mod cp_fm_diag.mod cp_realspace_grid_cube.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 qs_tddfpt2_types.mod cp_fm_pool_types.mod cp_para_types.mod input_section_types.mod cp_fm_types.mod base_hooks.mod string_utilities.mod cp_log_handling.mod message_passing.mod cp_fm_basic_linalg.mod cp_output_handling.mod cp_blacs_env.mod kinds.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="\"Thu Oct 7 17:53:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_tddfpt2_types.mod cp_fm_pool_types.mod cp_para_types.mod input_section_types.mod cp_fm_types.mod base_hooks.mod string_utilities.mod cp_log_handling.mod message_passing.mod cp_fm_basic_linalg.mod cp_output_handling.mod cp_blacs_env.mod kinds.mod cp_files.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 xc_rho_set_types.mod xc_derivative_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_local_rho_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod xc_derivative_types.mod qs_rho_atom_types.mod qs_oce_types.mod virial_types.mod qs_rho_types.mod qs_environment_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_harmonics_atom.mod qs_vxc_atom.mod kinds.mod xc_xbecke88.mod util.mod input_constants.mod qs_rho_atom_methods.mod qs_collocate_density.mod pw_methods.mod mathconstants.mod xc_derivatives.mod cp_array_utils.mod qs_grid_atom.mod xc_atom.mod qs_integrate_potential.mod xc.mod qs_ks_atom.mod cp_dbcsr_operations.mod qs_gapw_densities.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="\"Thu Oct 7 17:53:27 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 xc_rho_set_types.mod xc_derivative_set_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_local_rho_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod xc_derivative_types.mod qs_rho_atom_types.mod qs_oce_types.mod virial_types.mod qs_rho_types.mod qs_environment_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_harmonics_atom.mod qs_vxc_atom.mod kinds.mod xc_xbecke88.mod util.mod input_constants.mod qs_rho_atom_methods.mod qs_collocate_density.mod pw_methods.mod mathconstants.mod xc_derivatives.mod cp_array_utils.mod qs_grid_atom.mod xc_atom.mod qs_integrate_potential.mod xc.mod qs_ks_atom.mod cp_dbcsr_operations.mod qs_gapw_densities.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_tddfpt2_types.mod cell_types.mod cp_control_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod qs_scf_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod xc_pot_saop.mod qs_ks_methods.mod xtb_matrices.mod cp_fm_cholesky.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod qs_scf_methods.mod util.mod input_constants.mod cp_log_handling.mod message_passing.mod qs_scf_post_gpw.mod physcon.mod cp_array_utils.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_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="\"Thu Oct 7 17:53:38 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_tddfpt2_types.mod cell_types.mod cp_control_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod qs_scf_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod xc_pot_saop.mod qs_ks_methods.mod xtb_matrices.mod cp_fm_cholesky.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod qs_scf_methods.mod util.mod input_constants.mod cp_log_handling.mod message_passing.mod qs_scf_post_gpw.mod physcon.mod cp_array_utils.mod cp_fm_basic_linalg.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 particle_types.mod qs_tddfpt2_stda_types.mod qs_tddfpt2_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod virial_types.mod atprop_types.mod ewald_environment_types.mod ewald_pw_types.mod qs_environment_types.mod scf_control_types.mod input_section_types.mod base_hooks.mod cp_fm_struct.mod kinds.mod iterate_matrix.mod util.mod qs_tddfpt2_subgroups.mod cp_log_handling.mod message_passing.mod cp_dbcsr_cp2k_link.mod mathconstants.mod cp_fm_basic_linalg.mod cp_fm_diag.mod particle_methods.mod ewald_methods_tb.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="\"Thu Oct 7 17:53:43 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod qs_tddfpt2_stda_types.mod qs_tddfpt2_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod cp_fm_types.mod virial_types.mod atprop_types.mod ewald_environment_types.mod ewald_pw_types.mod qs_environment_types.mod scf_control_types.mod input_section_types.mod base_hooks.mod cp_fm_struct.mod kinds.mod iterate_matrix.mod util.mod qs_tddfpt2_subgroups.mod cp_log_handling.mod message_passing.mod cp_dbcsr_cp2k_link.mod mathconstants.mod cp_fm_basic_linalg.mod cp_fm_diag.mod particle_methods.mod ewald_methods_tb.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 xc_rho_set_types.mod qs_tddfpt2_types.mod pw_pool_types.mod pw_types.mod pw_env_types.mod admm_types.mod cp_fm_types.mod qs_rho_types.mod qs_environment_types.mod pw_poisson_types.mod base_hooks.mod hfx_admm_utils.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod pw_methods.mod cp_fm_basic_linalg.mod pw_poisson_methods.mod xc.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="\"Thu Oct 7 17:53:47 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 xc_rho_set_types.mod qs_tddfpt2_types.mod pw_pool_types.mod pw_types.mod pw_env_types.mod admm_types.mod cp_fm_types.mod qs_rho_types.mod qs_environment_types.mod pw_poisson_types.mod base_hooks.mod hfx_admm_utils.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod pw_methods.mod cp_fm_basic_linalg.mod pw_poisson_methods.mod xc.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 qs_tddfpt2_stda_types.mod qs_tddfpt2_types.mod pw_types.mod cp_control_types.mod cp_fm_types.mod qs_rho_types.mod qs_environment_types.mod base_hooks.mod qs_tddfpt2_densities.mod kinds.mod cp_gemm_interface.mod qs_tddfpt2_subgroups.mod qs_tddfpt2_operators.mod pw_methods.mod qs_integrate_potential.mod qs_tddfpt2_stda_utils.mod qs_rho_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_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="\"Thu Oct 7 17:53:53 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_tddfpt2_stda_types.mod qs_tddfpt2_types.mod pw_types.mod cp_control_types.mod cp_fm_types.mod qs_rho_types.mod qs_environment_types.mod base_hooks.mod qs_tddfpt2_densities.mod kinds.mod cp_gemm_interface.mod qs_tddfpt2_subgroups.mod qs_tddfpt2_operators.mod pw_methods.mod qs_integrate_potential.mod qs_tddfpt2_stda_utils.mod qs_rho_methods.mod cp_dbcsr_operations.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 qs_tddfpt2_types.mod cp_control_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod qs_scf_methods.mod qs_tddfpt2_subgroups.mod input_constants.mod cp_log_handling.mod physcon.mod qs_tddfpt2_operators.mod qs_tddfpt2_fhxc.mod qs_tddfpt2_restart.mod memory_utilities.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_tddfpt2_utils.mod cp_fm_diag.mod machine.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="\"Thu Oct 7 17:53:56 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_tddfpt2_types.mod cp_control_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod qs_scf_methods.mod qs_tddfpt2_subgroups.mod input_constants.mod cp_log_handling.mod physcon.mod qs_tddfpt2_operators.mod qs_tddfpt2_fhxc.mod qs_tddfpt2_restart.mod memory_utilities.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_tddfpt2_utils.mod cp_fm_diag.mod machine.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 qs_tddfpt2_stda_types.mod qs_tddfpt2_types.mod cell_types.mod admm_types.mod cp_control_types.mod cp_fm_pool_types.mod cp_fm_types.mod qs_environment_types.mod qs_scf_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod string_utilities.mod cp_blacs_env.mod qs_tddfpt2_densities.mod kinds.mod header.mod qs_scf_methods.mod qs_tddfpt2_subgroups.mod input_constants.mod cp_log_handling.mod qs_tddfpt2_properties.mod bibliography.mod qs_tddfpt2_restart.mod cp_output_handling.mod qs_tddfpt2_utils.mod machine.mod qs_tddfpt2_stda_utils.mod qs_tddfpt2_eigensolver.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="\"Thu Oct 7 17:54:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_tddfpt2_stda_types.mod qs_tddfpt2_types.mod cell_types.mod admm_types.mod cp_control_types.mod cp_fm_pool_types.mod cp_fm_types.mod qs_environment_types.mod qs_scf_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod string_utilities.mod cp_blacs_env.mod qs_tddfpt2_densities.mod kinds.mod header.mod qs_scf_methods.mod qs_tddfpt2_subgroups.mod input_constants.mod cp_log_handling.mod qs_tddfpt2_properties.mod bibliography.mod qs_tddfpt2_restart.mod cp_output_handling.mod qs_tddfpt2_utils.mod machine.mod qs_tddfpt2_stda_utils.mod qs_tddfpt2_eigensolver.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_control_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_log_handling.mod message_passing.mod qs_matrix_pools.mod cp_fm_basic_linalg.mod cp_output_handling.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/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="\"Thu Oct 7 17:54:04 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_control_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_log_handling.mod message_passing.mod qs_matrix_pools.mod cp_fm_basic_linalg.mod cp_output_handling.mod mathlib.mod cp_dbcsr_operations.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 particle_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_p_env_types.mod cp_para_types.mod qs_linres_types.mod cp_fm_types.mod qs_environment_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_fermi_contact.mod qs_linres_methods.mod cp_fm_struct.mod kinds.mod cp_log_handling.mod qs_elec_field.mod physcon.mod cp_dbcsr_cp2k_link.mod qs_matrix_pools.mod memory_utilities.mod cp_fm_basic_linalg.mod cp_output_handling.mod mathlib.mod particle_methods.mod qs_spin_orbit.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="\"Thu Oct 7 17:54:06 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_p_env_types.mod cp_para_types.mod qs_linres_types.mod cp_fm_types.mod qs_environment_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_fermi_contact.mod qs_linres_methods.mod cp_fm_struct.mod kinds.mod cp_log_handling.mod qs_elec_field.mod physcon.mod cp_dbcsr_cp2k_link.mod qs_matrix_pools.mod memory_utilities.mod cp_fm_basic_linalg.mod cp_output_handling.mod mathlib.mod particle_methods.mod qs_spin_orbit.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_pool_types.mod pw_types.mod cell_types.mod pw_grid_types.mod base_hooks.mod pw_methods.mod mathconstants.mod kinds.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="\"Thu Oct 7 17:54:12 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_pool_types.mod pw_types.mod cell_types.mod pw_grid_types.mod base_hooks.mod pw_methods.mod mathconstants.mod kinds.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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod qs_linres_types.mod qs_rho_atom_types.mod qs_rho_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod qs_harmonics_atom.mod kinds.mod qs_linres_op.mod util.mod cp_log_handling.mod message_passing.mod pw_spline_utils.mod qs_linres_nmr_epr_common_utils.mod pw_methods.mod qs_grid_atom.mod cp_output_handling.mod mathlib.mod qs_core_energies.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="\"Thu Oct 7 17:54:12 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod qs_linres_types.mod qs_rho_atom_types.mod qs_rho_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod qs_harmonics_atom.mod kinds.mod qs_linres_op.mod util.mod cp_log_handling.mod message_passing.mod pw_spline_utils.mod qs_linres_nmr_epr_common_utils.mod pw_methods.mod qs_grid_atom.mod cp_output_handling.mod mathlib.mod qs_core_energies.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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_local_rho_types.mod qs_rho0_types.mod cp_para_types.mod qs_linres_types.mod qs_ks_types.mod qs_rho_atom_types.mod qs_oce_types.mod qs_rho_types.mod qs_environment_types.mod external_potential_types.mod pw_poisson_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod qs_harmonics_atom.mod qs_ks_methods.mod qs_vxc_atom.mod kinds.mod util.mod cp_log_handling.mod qs_rho_atom_methods.mod qs_vxc.mod hartree_local_methods.mod pw_methods.mod mathconstants.mod qs_grid_atom.mod cp_output_handling.mod cp_realspace_grid_cube.mod pw_poisson_methods.mod qs_gapw_densities.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="\"Thu Oct 7 17:54:15 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_local_rho_types.mod qs_rho0_types.mod cp_para_types.mod qs_linres_types.mod qs_ks_types.mod qs_rho_atom_types.mod qs_oce_types.mod qs_rho_types.mod qs_environment_types.mod external_potential_types.mod pw_poisson_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod qs_harmonics_atom.mod qs_ks_methods.mod qs_vxc_atom.mod kinds.mod util.mod cp_log_handling.mod qs_rho_atom_methods.mod qs_vxc.mod hartree_local_methods.mod pw_methods.mod mathconstants.mod qs_grid_atom.mod cp_output_handling.mod cp_realspace_grid_cube.mod pw_poisson_methods.mod qs_gapw_densities.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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_linres_types.mod qs_rho_atom_types.mod qs_rho_types.mod qs_environment_types.mod scf_control_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod kinds.mod cp_log_handling.mod physcon.mod mathconstants.mod qs_matrix_pools.mod cp_output_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="\"Thu Oct 7 17:54:20 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod qs_linres_types.mod qs_rho_atom_types.mod qs_rho_types.mod qs_environment_types.mod scf_control_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod kinds.mod cp_log_handling.mod physcon.mod mathconstants.mod qs_matrix_pools.mod cp_output_handling.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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_loc_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_p_env_types.mod cp_para_types.mod qs_linres_types.mod cp_fm_types.mod qs_rho_types.mod qs_environment_types.mod scf_control_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_linres_methods.mod cp_fm_struct.mod kinds.mod qs_linres_op.mod input_constants.mod cp_log_handling.mod qs_operators_ao.mod cp_dbcsr_cp2k_link.mod pw_methods.mod qs_matrix_pools.mod cp_array_utils.mod memory_utilities.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_loc_methods.mod particle_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_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="\"Thu Oct 7 17:54:22 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_loc_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod qs_p_env_types.mod cp_para_types.mod qs_linres_types.mod cp_fm_types.mod qs_rho_types.mod qs_environment_types.mod scf_control_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_linres_methods.mod cp_fm_struct.mod kinds.mod qs_linres_op.mod input_constants.mod cp_log_handling.mod qs_operators_ao.mod cp_dbcsr_cp2k_link.mod pw_methods.mod qs_matrix_pools.mod cp_array_utils.mod memory_utilities.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_loc_methods.mod particle_methods.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 cell_types.mod cp_control_types.mod qs_p_env_types.mod cp_para_types.mod qs_linres_types.mod cp_fm_types.mod force_env_types.mod qs_environment_types.mod input_section_types.mod cp_result_types.mod qs_mo_types.mod base_hooks.mod qs_linres_methods.mod cp_fm_struct.mod kinds.mod cp_log_handling.mod bibliography.mod physcon.mod mathconstants.mod qs_matrix_pools.mod cp_fm_basic_linalg.mod cp_output_handling.mod cp_result_methods.mod machine.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="\"Thu Oct 7 17:54:29 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cell_types.mod cp_control_types.mod qs_p_env_types.mod cp_para_types.mod qs_linres_types.mod cp_fm_types.mod force_env_types.mod qs_environment_types.mod input_section_types.mod cp_result_types.mod qs_mo_types.mod base_hooks.mod qs_linres_methods.mod cp_fm_struct.mod kinds.mod cp_log_handling.mod bibliography.mod physcon.mod mathconstants.mod qs_matrix_pools.mod cp_fm_basic_linalg.mod cp_output_handling.mod cp_result_methods.mod machine.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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod pw_grid_types.mod qs_linres_types.mod qs_rho_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod qs_harmonics_atom.mod kinds.mod qs_linres_op.mod util.mod cp_log_handling.mod message_passing.mod pw_spline_utils.mod qs_linres_nmr_epr_common_utils.mod pw_methods.mod mathconstants.mod qs_grid_atom.mod cp_output_handling.mod mathlib.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="\"Thu Oct 7 17:54:32 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod pw_grid_types.mod qs_linres_types.mod qs_rho_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod qs_harmonics_atom.mod kinds.mod qs_linres_op.mod util.mod cp_log_handling.mod message_passing.mod pw_spline_utils.mod qs_linres_nmr_epr_common_utils.mod pw_methods.mod mathconstants.mod qs_grid_atom.mod cp_output_handling.mod mathlib.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 scf_control_types.mod particle_types.mod cp_control_types.mod atomic_kind_types.mod cell_types.mod input_section_types.mod pw_env_types.mod qs_linres_types.mod qs_environment_types.mod cp_parser_types.mod base_hooks.mod cp_log_handling.mod qs_matrix_pools.mod cp_units.mod memory_utilities.mod cp_output_handling.mod kinds.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="\"Thu Oct 7 17:54:37 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 scf_control_types.mod particle_types.mod cp_control_types.mod atomic_kind_types.mod cell_types.mod input_section_types.mod pw_env_types.mod qs_linres_types.mod qs_environment_types.mod cp_parser_types.mod base_hooks.mod cp_log_handling.mod qs_matrix_pools.mod cp_units.mod memory_utilities.mod cp_output_handling.mod kinds.mod cp_parser_methods.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 cp_control_types.mod qs_p_env_types.mod qs_linres_types.mod force_env_types.mod qs_rho_types.mod qs_environment_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod qs_linres_methods.mod qs_linres_issc_utils.mod qs_linres_op.mod qs_linres_epr_ownutils.mod input_constants.mod cp_log_handling.mod qs_linres_epr_nablavks.mod qs_linres_epr_utils.mod bibliography.mod qs_linres_current_utils.mod qs_linres_current.mod qs_linres_polar_utils.mod cp_output_handling.mod qs_p_env_methods.mod qs_linres_nmr_shift.mod qs_linres_nmr_utils.mod qs_rho_methods.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="\"Thu Oct 7 17:54:38 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_control_types.mod qs_p_env_types.mod qs_linres_types.mod force_env_types.mod qs_rho_types.mod qs_environment_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod qs_linres_methods.mod qs_linres_issc_utils.mod qs_linres_op.mod qs_linres_epr_ownutils.mod input_constants.mod cp_log_handling.mod qs_linres_epr_nablavks.mod qs_linres_epr_utils.mod bibliography.mod qs_linres_current_utils.mod qs_linres_current.mod qs_linres_polar_utils.mod cp_output_handling.mod qs_p_env_methods.mod qs_linres_nmr_shift.mod qs_linres_nmr_utils.mod qs_rho_methods.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 pw_env_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_fm_types.mod atprop_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod scf_control_types.mod qs_energy_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_ks_methods.mod xas_methods.mod cp_fm_struct.mod kinds.mod cp_control_utils.mod et_coupling_proj.mod kpoint_methods.mod mp2.mod qs_scf.mod qs_integrate_potential.mod xas_tdp_methods.mod qs_tddfpt2_methods.mod et_coupling.mod cp_external_control.mod qs_linres_module.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="\"Thu Oct 7 17:54:43 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_env_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_fm_types.mod atprop_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod scf_control_types.mod qs_energy_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_ks_methods.mod xas_methods.mod cp_fm_struct.mod kinds.mod cp_control_utils.mod et_coupling_proj.mod kpoint_methods.mod mp2.mod qs_scf.mod qs_integrate_potential.mod xas_tdp_methods.mod qs_tddfpt2_methods.mod et_coupling.mod cp_external_control.mod qs_linres_module.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 cp_control_types.mod qs_energy_types.mod qs_environment_types.mod lri_environment_methods.mod energy_corrections.mod qs_environment_methods.mod base_hooks.mod qs_ks_methods.mod qs_scf.mod almo_scf.mod dm_ls_scf.mod qs_energy_init.mod qs_energy_utils.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="\"Thu Oct 7 17:54:46 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_control_types.mod qs_energy_types.mod qs_environment_types.mod lri_environment_methods.mod energy_corrections.mod qs_environment_methods.mod base_hooks.mod qs_ks_methods.mod qs_scf.mod almo_scf.mod dm_ls_scf.mod qs_energy_init.mod qs_energy_utils.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 particle_types.mod atomic_kind_types.mod admm_types.mod cp_control_types.mod qs_neighbor_list_types.mod rt_propagation_types.mod cp_fm_types.mod qs_ks_types.mod qs_environment_types.mod qs_force_types.mod qs_mo_types.mod base_hooks.mod cp_fm_vect.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod qs_overlap.mod cp_dbcsr_cp2k_link.mod mathconstants.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="\"Thu Oct 7 17:54:49 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod admm_types.mod cp_control_types.mod qs_neighbor_list_types.mod rt_propagation_types.mod cp_fm_types.mod qs_ks_types.mod qs_environment_types.mod qs_force_types.mod qs_mo_types.mod base_hooks.mod cp_fm_vect.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod qs_overlap.mod cp_dbcsr_cp2k_link.mod mathconstants.mod cp_dbcsr_operations.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 particle_types.mod atomic_kind_types.mod qs_subsys_types.mod admm_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_mo_types.mod virial_types.mod qs_rho_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod qs_force_types.mod lri_environment_types.mod qs_energy.mod base_hooks.mod xtb_matrices.mod qs_ks_methods.mod qs_scf_post_scf.mod se_core_core.mod kinds.mod cp_dbcsr_operations.mod input_constants.mod cp_log_handling.mod message_passing.mod rt_propagation_forces.mod dft_plus_u.mod cp_dbcsr_output.mod ri_environment_methods.mod admm_methods.mod cp_output_handling.mod qs_external_potential.mod qs_core_hamiltonian.mod energy_corrections.mod qs_environment_methods.mod se_core_matrix.mod mulliken.mod qs_dftb_matrices.mod qs_rho_methods.mod qs_dftb_dispersion.mod efield_utils.mod qs_core_energies.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="\"Thu Oct 7 17:54:52 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod qs_subsys_types.mod admm_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_mo_types.mod virial_types.mod qs_rho_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod qs_force_types.mod lri_environment_types.mod qs_energy.mod base_hooks.mod xtb_matrices.mod qs_ks_methods.mod qs_scf_post_scf.mod se_core_core.mod kinds.mod cp_dbcsr_operations.mod input_constants.mod cp_log_handling.mod message_passing.mod rt_propagation_forces.mod dft_plus_u.mod cp_dbcsr_output.mod ri_environment_methods.mod admm_methods.mod cp_output_handling.mod qs_external_potential.mod qs_core_hamiltonian.mod energy_corrections.mod qs_environment_methods.mod se_core_matrix.mod mulliken.mod qs_dftb_matrices.mod qs_rho_methods.mod qs_dftb_dispersion.mod efield_utils.mod qs_core_energies.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 particle_types.mod atomic_kind_types.mod cell_types.mod qmmm_types_low.mod multipole_types.mod semi_empirical_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod qs_ks_qmmm_types.mod qs_rho_types.mod qs_environment_types.mod base_hooks.mod semi_empirical_utils.mod kinds.mod qmmm_util.mod input_constants.mod message_passing.mod semi_empirical_int_arrays.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="\"Thu Oct 7 17:54:58 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod qmmm_types_low.mod multipole_types.mod semi_empirical_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod qs_ks_qmmm_types.mod qs_rho_types.mod qs_environment_types.mod base_hooks.mod semi_empirical_utils.mod kinds.mod qmmm_util.mod input_constants.mod message_passing.mod semi_empirical_int_arrays.mod semi_empirical_integrals.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 particle_types.mod atomic_kind_types.mod cell_types.mod qmmm_types_low.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod xtb_types.mod cp_para_types.mod qs_ks_types.mod qs_dftb_types.mod qs_ks_qmmm_types.mod qs_rho_types.mod ewald_environment_types.mod ewald_pw_types.mod qs_environment_types.mod pw_poisson_types.mod input_section_types.mod base_hooks.mod qs_neighbor_lists.mod kinds.mod qmmm_util.mod input_constants.mod message_passing.mod qs_overlap.mod qs_dftb_utils.mod mulliken.mod spme.mod qs_dftb_matrices.mod qs_dftb_coulomb.mod cp_dbcsr_operations.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="\"Thu Oct 7 17:55:01 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod qmmm_types_low.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod xtb_types.mod cp_para_types.mod qs_ks_types.mod qs_dftb_types.mod qs_ks_qmmm_types.mod qs_rho_types.mod ewald_environment_types.mod ewald_pw_types.mod qs_environment_types.mod pw_poisson_types.mod input_section_types.mod base_hooks.mod qs_neighbor_lists.mod kinds.mod qmmm_util.mod input_constants.mod message_passing.mod qs_overlap.mod qs_dftb_utils.mod mulliken.mod spme.mod qs_dftb_matrices.mod qs_dftb_coulomb.mod cp_dbcsr_operations.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 pw_types.mod cell_types.mod base_hooks.mod ao_util.mod cube_utils.mod kinds.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="\"Thu Oct 7 17:55:06 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_types.mod cell_types.mod base_hooks.mod ao_util.mod cube_utils.mod kinds.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 particle_types.mod atomic_kind_types.mod cell_types.mod qmmm_types_low.mod multipole_types.mod semi_empirical_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_ks_types.mod qs_ks_qmmm_types.mod qs_environment_types.mod qs_energy_types.mod base_hooks.mod qs_neighbor_lists.mod semi_empirical_utils.mod kinds.mod qmmm_util.mod input_constants.mod cp_log_handling.mod message_passing.mod semi_empirical_int_arrays.mod cp_dbcsr_output.mod qs_overlap.mod cp_output_handling.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/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="\"Thu Oct 7 17:55:08 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod qmmm_types_low.mod multipole_types.mod semi_empirical_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_ks_types.mod qs_ks_qmmm_types.mod qs_environment_types.mod qs_energy_types.mod base_hooks.mod qs_neighbor_lists.mod semi_empirical_utils.mod kinds.mod qmmm_util.mod input_constants.mod cp_log_handling.mod message_passing.mod semi_empirical_int_arrays.mod cp_dbcsr_output.mod qs_overlap.mod cp_output_handling.mod semi_empirical_integrals.mod cp_dbcsr_operations.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 particle_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod qmmm_types_low.mod qmmm_gaussian_types.mod cp_control_types.mod cp_para_types.mod qs_ks_qmmm_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod cp_spline_utils.mod kinds.mod qmmm_util.mod input_constants.mod cp_log_handling.mod message_passing.mod pw_methods.mod qmmm_se_energy.mod qmmm_tb_methods.mod cp_output_handling.mod cp_realspace_grid_cube.mod mm_collocate_potential.mod cube_utils.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="\"Thu Oct 7 17:55:10 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod qmmm_types_low.mod qmmm_gaussian_types.mod cp_control_types.mod cp_para_types.mod qs_ks_qmmm_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod cp_spline_utils.mod kinds.mod qmmm_util.mod input_constants.mod cp_log_handling.mod message_passing.mod pw_methods.mod qmmm_se_energy.mod qmmm_tb_methods.mod cp_output_handling.mod cp_realspace_grid_cube.mod mm_collocate_potential.mod cube_utils.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 particle_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod qmmm_types_low.mod qmmm_gaussian_types.mod cp_control_types.mod cp_para_types.mod qs_ks_qmmm_types.mod qs_rho_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod cp_spline_utils.mod kinds.mod qmmm_util.mod input_constants.mod cp_log_handling.mod message_passing.mod qmmm_se_forces.mod pw_methods.mod qmmm_tb_methods.mod cp_output_handling.mod mm_collocate_potential.mod cube_utils.mod qmmm_gpw_energy.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="\"Thu Oct 7 17:55:14 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod qmmm_types_low.mod qmmm_gaussian_types.mod cp_control_types.mod cp_para_types.mod qs_ks_qmmm_types.mod qs_rho_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod cp_spline_utils.mod kinds.mod qmmm_util.mod input_constants.mod cp_log_handling.mod message_passing.mod qmmm_se_forces.mod pw_methods.mod qmmm_tb_methods.mod cp_output_handling.mod mm_collocate_potential.mod cube_utils.mod qmmm_gpw_energy.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 particle_types.mod cell_types.mod qmmm_types_low.mod fist_energy_types.mod qmmm_types.mod fist_environment_types.mod qs_environment_types.mod cp_subsys_types.mod qs_energy_types.mod input_section_types.mod cp_result_types.mod base_hooks.mod kinds.mod qs_force.mod fist_force.mod qmmm_util.mod cp_log_handling.mod qmmm_links_methods.mod physcon.mod qmmm_gpw_forces.mod cp_output_handling.mod cp_result_methods.mod qmmm_gpw_energy.mod qs_ks_qmmm_methods.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="\"Thu Oct 7 17:55:19 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod cell_types.mod qmmm_types_low.mod fist_energy_types.mod qmmm_types.mod fist_environment_types.mod qs_environment_types.mod cp_subsys_types.mod qs_energy_types.mod input_section_types.mod cp_result_types.mod base_hooks.mod kinds.mod qs_force.mod fist_force.mod qmmm_util.mod cp_log_handling.mod qmmm_links_methods.mod physcon.mod qmmm_gpw_forces.mod cp_output_handling.mod cp_result_methods.mod qmmm_gpw_energy.mod qs_ks_qmmm_methods.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 particle_types.mod molecule_kind_types.mod molecule_kind_list_types.mod particle_list_types.mod force_env_types.mod molecule_types.mod cell_types.mod distribution_1d_types.mod cp_subsys_types.mod molecule_list_types.mod base_hooks.mod message_passing.mod colvar_methods.mod constraint_fxd.mod kinds.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="\"Thu Oct 7 17:55:22 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod molecule_kind_types.mod molecule_kind_list_types.mod particle_list_types.mod force_env_types.mod molecule_types.mod cell_types.mod distribution_1d_types.mod cp_subsys_types.mod molecule_list_types.mod base_hooks.mod message_passing.mod colvar_methods.mod constraint_fxd.mod kinds.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 cell_types.mod cp_para_types.mod nnp_environment_types.mod base_hooks.mod mathconstants.mod cp_log_handling.mod kinds.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="\"Thu Oct 7 17:55:24 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cell_types.mod cp_para_types.mod nnp_environment_types.mod base_hooks.mod mathconstants.mod cp_log_handling.mod kinds.mod periodic_table.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 cp_para_types.mod nnp_environment_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/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="\"Thu Oct 7 17:55:30 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_para_types.mod nnp_environment_types.mod base_hooks.mod cp_log_handling.mod kinds.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 particle_types.mod atomic_kind_types.mod input_section_types.mod distribution_1d_types.mod cp_subsys_types.mod nnp_environment_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod nnp_acsf.mod cp_units.mod cp_output_handling.mod kinds.mod nnp_model.mod physcon.mod periodic_table.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="\"Thu Oct 7 17:55:31 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod input_section_types.mod distribution_1d_types.mod cp_subsys_types.mod nnp_environment_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod nnp_acsf.mod cp_units.mod cp_output_handling.mod kinds.mod nnp_model.mod physcon.mod periodic_table.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_control_types.mod embed_types.mod cp_para_types.mod input_section_types.mod cp_fm_types.mod qs_environment_types.mod qs_mo_types.mod base_hooks.mod cp_gemm_interface.mod kinds.mod cp_blacs_env.mod cp_fm_struct.mod cp_dbcsr_operations.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="\"Thu Oct 7 17:55:33 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_control_types.mod embed_types.mod cp_para_types.mod input_section_types.mod cp_fm_types.mod qs_environment_types.mod qs_mo_types.mod base_hooks.mod cp_gemm_interface.mod kinds.mod cp_blacs_env.mod cp_fm_struct.mod cp_dbcsr_operations.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 mixed_cdft_types.mod atomic_kind_types.mod pw_pool_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod pw_grid_types.mod cp_fm_types.mod force_env_types.mod hirshfeld_types.mod mixed_environment_types.mod qs_cdft_types.mod global_types.mod qs_environment_types.mod cp_subsys_types.mod input_section_types.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod kinds.mod cp_files.mod input_constants.mod cp_log_handling.mod message_passing.mod pw_grids.mod gaussian_gridlevels.mod d3_poly.mod cp_array_utils.mod cp_output_handling.mod cube_utils.mod cp_realspace_grid_init.mod pw_env_methods.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_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="\"Thu Oct 7 17:55:35 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mixed_cdft_types.mod atomic_kind_types.mod pw_pool_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod pw_grid_types.mod cp_fm_types.mod force_env_types.mod hirshfeld_types.mod mixed_environment_types.mod qs_cdft_types.mod global_types.mod qs_environment_types.mod cp_subsys_types.mod input_section_types.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod kinds.mod cp_files.mod input_constants.mod cp_log_handling.mod message_passing.mod pw_grids.mod gaussian_gridlevels.mod d3_poly.mod cp_array_utils.mod cp_output_handling.mod cube_utils.mod cp_realspace_grid_init.mod pw_env_methods.mod cp_dbcsr_operations.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 particle_types.mod mixed_cdft_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod cp_fm_types.mod force_env_types.mod hirshfeld_types.mod mixed_environment_types.mod qs_cdft_types.mod qs_environment_types.mod cp_subsys_types.mod particle_list_types.mod qs_energy_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod ao_util.mod hirshfeld_methods.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod util.mod grid_api.mod input_constants.mod cp_log_handling.mod message_passing.mod qs_mo_io.mod pw_methods.mod cp_array_utils.mod memory_utilities.mod cp_fm_basic_linalg.mod cp_output_handling.mod mixed_cdft_utils.mod cp_dbcsr_diag.mod cp_realspace_grid_cube.mod mathlib.mod machine.mod cp_units.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="\"Thu Oct 7 17:55:47 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod mixed_cdft_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod realspace_grid_types.mod qs_kind_types.mod cp_control_types.mod cp_fm_types.mod force_env_types.mod hirshfeld_types.mod mixed_environment_types.mod qs_cdft_types.mod qs_environment_types.mod cp_subsys_types.mod particle_list_types.mod qs_energy_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod ao_util.mod hirshfeld_methods.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod util.mod grid_api.mod input_constants.mod cp_log_handling.mod message_passing.mod qs_mo_io.mod pw_methods.mod cp_array_utils.mod memory_utilities.mod cp_fm_basic_linalg.mod cp_output_handling.mod mixed_cdft_utils.mod cp_dbcsr_diag.mod cp_realspace_grid_cube.mod mathlib.mod machine.mod cp_units.mod cp_dbcsr_operations.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 particle_types.mod cp_control_types.mod qs_energy_types.mod cell_types.mod qs_environment_types.mod force_env_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="\"Thu Oct 7 17:56:18 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod cp_control_types.mod qs_energy_types.mod cell_types.mod qs_environment_types.mod force_env_types.mod base_hooks.mod kinds.mod physcon.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 particle_types.mod qmmmx_types.mod qmmm_types.mod cell_types.mod fist_environment_types.mod input_section_types.mod qmmm_types_low.mod qs_environment_types.mod cp_subsys_types.mod base_hooks.mod qmmmx_util.mod input_constants.mod qmmm_util.mod kinds.mod qmmm_force.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="\"Thu Oct 7 17:56:20 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod qmmmx_types.mod qmmm_types.mod cell_types.mod fist_environment_types.mod input_section_types.mod qmmm_types_low.mod qs_environment_types.mod cp_subsys_types.mod base_hooks.mod qmmmx_util.mod input_constants.mod qmmm_util.mod kinds.mod qmmm_force.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 particle_types.mod cp_control_types.mod qs_energy_types.mod qs_environment_types.mod force_env_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="\"Thu Oct 7 17:56:23 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod cp_control_types.mod qs_energy_types.mod qs_environment_types.mod force_env_types.mod base_hooks.mod kinds.mod physcon.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="\"Thu Oct 7 17:56:24 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod particle_list_types.mod cell_types.mod fp_types.mod cp_subsys_types.mod base_hooks.mod mathconstants.mod cp_log_handling.mod cp_output_handling.mod kinds.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="\"Thu Oct 7 17:56:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod particle_list_types.mod cell_types.mod fp_types.mod cp_subsys_types.mod base_hooks.mod mathconstants.mod cp_log_handling.mod cp_output_handling.mod kinds.mod beta_gamma_psi.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 particle_list_types.mod force_env_types.mod input_section_types.mod cp_subsys_types.mod base_hooks.mod string_utilities.mod cp_log_handling.mod memory_utilities.mod force_fields_util.mod kinds.mod fparser.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="\"Thu Oct 7 17:56:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_list_types.mod force_env_types.mod input_section_types.mod cp_subsys_types.mod base_hooks.mod string_utilities.mod cp_log_handling.mod memory_utilities.mod force_fields_util.mod kinds.mod fparser.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 particle_types.mod atomic_kind_types.mod eip_environment_types.mod atomic_kind_list_types.mod cell_types.mod cp_para_types.mod input_section_types.mod distribution_1d_types.mod cp_subsys_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod cp_output_handling.mod kinds.mod physcon.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="\"Thu Oct 7 17:56:27 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod eip_environment_types.mod atomic_kind_list_types.mod cell_types.mod cp_para_types.mod input_section_types.mod distribution_1d_types.mod cp_subsys_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod cp_output_handling.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 pwdft_environment_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod nnp_environment_types.mod mixed_energy_types.mod cp_control_types.mod cp_iter_types.mod cp_para_types.mod cp_fm_types.mod force_env_types.mod metadynamics_types.mod mixed_environment_types.mod global_types.mod molecule_kind_types.mod virial_types.mod molecule_kind_list_types.mod atprop_types.mod qmmm_types.mod fist_environment_types.mod qs_environment_types.mod qs_rho_types.mod cp_subsys_types.mod particle_list_types.mod qmmmx_types.mod embed_types.mod eip_environment_types.mod qs_energy_types.mod input_section_types.mod cp_result_types.mod base_hooks.mod constraint_vsite.mod pwdft_environment.mod string_utilities.mod virial_methods.mod force_env_utils.mod kinds.mod optimize_embedding_potential.mod fist_force.mod qmmm_force.mod qs_force.mod qmmm_util.mod input_constants.mod cp_log_handling.mod message_passing.mod restraint.mod nnp_force.mod kahan_sum.mod bibliography.mod optimize_dmfet_potential.mod physcon.mod mixed_cdft_methods.mod pw_methods.mod scine_utils.mod cp_fm_basic_linalg.mod cp_output_handling.mod mixed_environment_utils.mod qmmmx_force.mod force_fields_util.mod cp_result_methods.mod grrm_utils.mod fp_methods.mod cp_para_env.mod mathlib.mod machine.mod external_potential_methods.mod constraint_fxd.mod eip_silicon.mod fparser.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="\"Thu Oct 7 17:56:32 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pwdft_environment_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_env_types.mod nnp_environment_types.mod mixed_energy_types.mod cp_control_types.mod cp_iter_types.mod cp_para_types.mod cp_fm_types.mod force_env_types.mod metadynamics_types.mod mixed_environment_types.mod global_types.mod molecule_kind_types.mod virial_types.mod molecule_kind_list_types.mod atprop_types.mod qmmm_types.mod fist_environment_types.mod qs_environment_types.mod qs_rho_types.mod cp_subsys_types.mod particle_list_types.mod qmmmx_types.mod embed_types.mod eip_environment_types.mod qs_energy_types.mod input_section_types.mod cp_result_types.mod base_hooks.mod constraint_vsite.mod pwdft_environment.mod string_utilities.mod virial_methods.mod force_env_utils.mod kinds.mod optimize_embedding_potential.mod fist_force.mod qmmm_force.mod qs_force.mod qmmm_util.mod input_constants.mod cp_log_handling.mod message_passing.mod restraint.mod nnp_force.mod kahan_sum.mod bibliography.mod optimize_dmfet_potential.mod physcon.mod mixed_cdft_methods.mod pw_methods.mod scine_utils.mod cp_fm_basic_linalg.mod cp_output_handling.mod mixed_environment_utils.mod qmmmx_force.mod force_fields_util.mod cp_result_methods.mod grrm_utils.mod fp_methods.mod cp_para_env.mod mathlib.mod machine.mod external_potential_methods.mod constraint_fxd.mod eip_silicon.mod fparser.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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod nnp_environment_types.mod cp_para_types.mod molecule_kind_types.mod distribution_1d_types.mod cp_subsys_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod distribution_methods.mod kinds.mod cp_parser_methods.mod cp_subsys_methods.mod cp_log_handling.mod bibliography.mod nnp_model.mod periodic_table.mod cell_methods.mod nnp_acsf.mod particle_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="\"Thu Oct 7 17:56:46 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod nnp_environment_types.mod cp_para_types.mod molecule_kind_types.mod distribution_1d_types.mod cp_subsys_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod distribution_methods.mod kinds.mod cp_parser_methods.mod cp_subsys_methods.mod cp_log_handling.mod bibliography.mod nnp_model.mod periodic_table.mod cell_methods.mod nnp_acsf.mod particle_methods.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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_units.mod cp_output_handling.mod bibliography.mod kinds.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="\"Thu Oct 7 17:56:50 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_units.mod cp_output_handling.mod bibliography.mod kinds.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 input_enumeration_types.mod force_env_types.mod cp_para_types.mod input_section_types.mod metadynamics_types.mod input_keyword_types.mod cp_subsys_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod machine.mod message_passing.mod cp_output_handling.mod kinds.mod input_cp2k_free_energy.mod cp_files.mod physcon.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="\"Thu Oct 7 17:56:51 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_enumeration_types.mod force_env_types.mod cp_para_types.mod input_section_types.mod metadynamics_types.mod input_keyword_types.mod cp_subsys_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod machine.mod message_passing.mod cp_output_handling.mod kinds.mod input_cp2k_free_energy.mod cp_files.mod physcon.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 global_types.mod force_env_types.mod cp_para_types.mod fist_environment_types.mod input_section_types.mod qmmm_types_low.mod cp_subsys_types.mod force_env_methods.mod base_hooks.mod fist_environment.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="\"Thu Oct 7 17:56:54 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 global_types.mod force_env_types.mod cp_para_types.mod fist_environment_types.mod input_section_types.mod qmmm_types_low.mod cp_subsys_types.mod force_env_methods.mod base_hooks.mod fist_environment.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 pwdft_environment_types.mod input_enumeration_types.mod cell_types.mod nnp_environment_types.mod cp_para_types.mod force_env_types.mod input_keyword_types.mod metadynamics_types.mod mixed_environment_types.mod global_types.mod virial_types.mod qmmm_types.mod fp_types.mod qs_environment_types.mod cp_subsys_types.mod qmmmx_types.mod embed_types.mod eip_environment_types.mod input_section_types.mod timings_types.mod cp_result_types.mod base_hooks.mod pwdft_environment.mod input_cp2k_force_eval.mod environment.mod input_cp2k_read.mod eip_environment.mod qs_environment.mod embed_main.mod cp_files.mod kinds.mod qmmmx_create.mod grid_api.mod input_cp2k_check.mod input_constants.mod cp_log_handling.mod message_passing.mod bibliography.mod mixed_main.mod cp2k_info.mod periodic_table.mod force_env_methods.mod cp_error_handling.mod string_table.mod cp_output_handling.mod cp_result_methods.mod timings.mod cp_para_env.mod machine.mod nnp_environment.mod reference_manager.mod metadynamics_utils.mod fist_main.mod qmmm_create.mod pw_cuda.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="\"Thu Oct 7 17:56:55 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pwdft_environment_types.mod input_enumeration_types.mod cell_types.mod nnp_environment_types.mod cp_para_types.mod force_env_types.mod input_keyword_types.mod metadynamics_types.mod mixed_environment_types.mod global_types.mod virial_types.mod qmmm_types.mod fp_types.mod qs_environment_types.mod cp_subsys_types.mod qmmmx_types.mod embed_types.mod eip_environment_types.mod input_section_types.mod timings_types.mod cp_result_types.mod base_hooks.mod pwdft_environment.mod input_cp2k_force_eval.mod environment.mod input_cp2k_read.mod eip_environment.mod qs_environment.mod embed_main.mod cp_files.mod kinds.mod qmmmx_create.mod grid_api.mod input_cp2k_check.mod input_constants.mod cp_log_handling.mod message_passing.mod bibliography.mod mixed_main.mod cp2k_info.mod periodic_table.mod force_env_methods.mod cp_error_handling.mod string_table.mod cp_output_handling.mod cp_result_methods.mod timings.mod cp_para_env.mod machine.mod nnp_environment.mod reference_manager.mod metadynamics_utils.mod fist_main.mod qmmm_create.mod pw_cuda.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 qs_wf_history_types.mod cp_para_types.mod cp_result_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod f77_interface.mod cp_output_handling.mod kinds.mod cp_result_methods.mod cp_para_env.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="\"Thu Oct 7 17:57:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_wf_history_types.mod cp_para_types.mod cp_result_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod f77_interface.mod cp_output_handling.mod kinds.mod cp_result_methods.mod cp_para_env.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 input_section_types.mod gle_system_types.mod simpar_types.mod replica_types.mod parallel_rng_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="\"Thu Oct 7 17:57:01 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_section_types.mod gle_system_types.mod simpar_types.mod replica_types.mod parallel_rng_types.mod base_hooks.mod cp_log_handling.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 input_constants.mod kinds.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="\"Thu Oct 7 17:57:02 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_constants.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="\"Thu Oct 7 17:57:03 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 17:57:03 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 particle_types.mod atomic_kind_types.mod thermostat_types.mod molecule_types.mod cell_types.mod cp_para_types.mod molecule_kind_types.mod qmmm_types.mod shell_potential_types.mod distribution_1d_types.mod molecule_list_types.mod extended_system_types.mod particle_list_types.mod input_section_types.mod simpar_types.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod motion_utils.mod physcon.mod cp_output_handling.mod machine.mod cp_units.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="\"Thu Oct 7 17:57:03 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod thermostat_types.mod molecule_types.mod cell_types.mod cp_para_types.mod molecule_kind_types.mod qmmm_types.mod shell_potential_types.mod distribution_1d_types.mod molecule_list_types.mod extended_system_types.mod particle_list_types.mod input_section_types.mod simpar_types.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod motion_utils.mod physcon.mod cp_output_handling.mod machine.mod cp_units.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 extended_system_types.mod molecule_kind_types.mod molecule_types.mod cell_types.mod cp_para_types.mod distribution_1d_types.mod simpar_types.mod base_hooks.mod input_constants.mod message_passing.mod memory_utilities.mod kinds.mod util.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="\"Thu Oct 7 17:57:08 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 extended_system_types.mod molecule_kind_types.mod molecule_types.mod cell_types.mod cp_para_types.mod distribution_1d_types.mod simpar_types.mod base_hooks.mod input_constants.mod message_passing.mod memory_utilities.mod kinds.mod util.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 extended_system_types.mod molecule_kind_types.mod thermostat_types.mod molecule_types.mod cp_para_types.mod distribution_1d_types.mod simpar_types.mod base_hooks.mod input_constants.mod message_passing.mod thermostat_mapping.mod kinds.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="\"Thu Oct 7 17:57:11 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 extended_system_types.mod molecule_kind_types.mod thermostat_types.mod molecule_types.mod cp_para_types.mod distribution_1d_types.mod simpar_types.mod base_hooks.mod input_constants.mod message_passing.mod thermostat_mapping.mod kinds.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 extended_system_types.mod global_types.mod molecule_kind_types.mod thermostat_types.mod molecule_types.mod cell_types.mod cp_para_types.mod input_section_types.mod distribution_1d_types.mod simpar_types.mod base_hooks.mod input_constants.mod input_cp2k_binary_restarts.mod thermostat_utils.mod kinds.mod extended_system_mapping.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="\"Thu Oct 7 17:57:12 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 extended_system_types.mod global_types.mod molecule_kind_types.mod thermostat_types.mod molecule_types.mod cell_types.mod cp_para_types.mod input_section_types.mod distribution_1d_types.mod simpar_types.mod base_hooks.mod input_constants.mod input_cp2k_binary_restarts.mod thermostat_utils.mod kinds.mod extended_system_mapping.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 extended_system_types.mod global_types.mod cell_types.mod input_section_types.mod force_env_types.mod simpar_types.mod base_hooks.mod input_constants.mod extended_system_init.mod kinds.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="\"Thu Oct 7 17:57:14 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 extended_system_types.mod global_types.mod cell_types.mod input_section_types.mod force_env_types.mod simpar_types.mod base_hooks.mod input_constants.mod extended_system_init.mod kinds.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 virial_types.mod md_ener_types.mod cell_types.mod input_section_types.mod force_env_types.mod base_hooks.mod cp_log_handling.mod cp_output_handling.mod colvar_utils.mod kinds.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="\"Thu Oct 7 17:57:15 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 virial_types.mod md_ener_types.mod cell_types.mod input_section_types.mod force_env_types.mod base_hooks.mod cp_log_handling.mod cp_output_handling.mod colvar_utils.mod kinds.mod true /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="\"Thu Oct 7 17:57:18 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 extended_system_types.mod free_energy_types.mod md_ener_types.mod thermal_region_types.mod thermostat_types.mod cell_types.mod cp_para_types.mod barostat_types.mod input_section_types.mod force_env_types.mod averages_types.mod simpar_types.mod reftraj_types.mod base_hooks.mod input_constants.mod kinds.mod cp_para_env.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="\"Thu Oct 7 17:57:18 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 extended_system_types.mod free_energy_types.mod md_ener_types.mod thermal_region_types.mod thermostat_types.mod cell_types.mod cp_para_types.mod barostat_types.mod input_section_types.mod force_env_types.mod averages_types.mod simpar_types.mod reftraj_types.mod base_hooks.mod input_constants.mod kinds.mod cp_para_env.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 cell_types.mod input_section_types.mod splines_types.mod parallel_rng_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="\"Thu Oct 7 17:57:20 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 'helium_types.mod' due to: helium_types.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/helium_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cell_types.mod input_section_types.mod splines_types.mod parallel_rng_types.mod base_hooks.mod cp_log_handling.mod kinds.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 input_val_types.mod input_section_types.mod parallel_rng_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="\"Thu Oct 7 17:57:20 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_val_types.mod input_section_types.mod parallel_rng_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 molecule_types.mod cell_types.mod multipole_types.mod nnp_environment_types.mod cp_control_types.mod cp_para_types.mod force_env_types.mod parallel_rng_types.mod molecule_kind_types.mod virial_types.mod atomic_kind_list_types.mod distribution_1d_types.mod qs_environment_types.mod cp_subsys_types.mod molecule_list_types.mod input_val_types.mod particle_list_types.mod eip_environment_types.mod input_section_types.mod base_hooks.mod string_utilities.mod kinds.mod cp_files.mod input_constants.mod message_passing.mod input_restart_rng.mod qmmm_ff_fist.mod cp_units.mod input_cp2k_restarts_util.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_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="\"Thu Oct 7 17:57:21 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 molecule_types.mod cell_types.mod multipole_types.mod nnp_environment_types.mod cp_control_types.mod cp_para_types.mod force_env_types.mod parallel_rng_types.mod molecule_kind_types.mod virial_types.mod atomic_kind_list_types.mod distribution_1d_types.mod qs_environment_types.mod cp_subsys_types.mod molecule_list_types.mod input_val_types.mod particle_list_types.mod eip_environment_types.mod input_section_types.mod base_hooks.mod string_utilities.mod kinds.mod cp_files.mod input_constants.mod message_passing.mod input_restart_rng.mod qmmm_ff_fist.mod cp_units.mod input_cp2k_restarts_util.mod cp_linked_list_input.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 mathconstants.mod input_constants.mod kinds.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="\"Thu Oct 7 17:57:24 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathconstants.mod input_constants.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 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_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="\"Thu Oct 7 17:57:26 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pint_types.mod input_section_types.mod base_hooks.mod kinds.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 input_constants.mod pint_normalmode.mod pint_staging.mod kinds.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="\"Thu Oct 7 17:57:28 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_constants.mod pint_normalmode.mod pint_staging.mod kinds.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 particle_types.mod al_system_types.mod neb_types.mod thermostat_types.mod gle_system_types.mod cp_para_types.mod force_env_types.mod metadynamics_types.mod parallel_rng_types.mod pint_types.mod molecule_kind_list_types.mod md_environment_types.mod atomic_kind_list_types.mod helium_types.mod cp_subsys_types.mod averages_types.mod molecule_list_types.mod extended_system_types.mod csvr_system_types.mod input_val_types.mod particle_list_types.mod input_section_types.mod simpar_types.mod base_hooks.mod string_utilities.mod input_restart_force_eval.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod cp2k_info.mod physcon.mod input_restart_rng.mod pint_transformations.mod memory_utilities.mod cp_output_handling.mod thermostat_utils.mod cp_linked_list_input.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="\"Thu Oct 7 17:57:30 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod al_system_types.mod neb_types.mod thermostat_types.mod gle_system_types.mod cp_para_types.mod force_env_types.mod metadynamics_types.mod parallel_rng_types.mod pint_types.mod molecule_kind_list_types.mod md_environment_types.mod atomic_kind_list_types.mod helium_types.mod cp_subsys_types.mod averages_types.mod molecule_list_types.mod extended_system_types.mod csvr_system_types.mod input_val_types.mod particle_list_types.mod input_section_types.mod simpar_types.mod base_hooks.mod string_utilities.mod input_restart_force_eval.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod cp2k_info.mod physcon.mod input_restart_rng.mod pint_transformations.mod memory_utilities.mod cp_output_handling.mod thermostat_utils.mod cp_linked_list_input.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 input_section_types.mod dimer_types.mod base_hooks.mod cp_log_handling.mod memory_utilities.mod kinds.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="\"Thu Oct 7 17:57:39 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:541: update target 'dimer_utils.mod' due to: dimer_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/dimer_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod dimer_types.mod base_hooks.mod cp_log_handling.mod memory_utilities.mod kinds.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/motion/gopt_f77_methods.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod gopt_param_types.mod atomic_kind_types.mod cell_types.mod dimer_types.mod gopt_f_types.mod cp_para_types.mod force_env_types.mod virial_types.mod atomic_kind_list_types.mod distribution_1d_types.mod cp_subsys_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod qmmmx_util.mod virial_methods.mod kinds.mod qmmm_util.mod input_constants.mod cp_log_handling.mod motion_utils.mod input_cp2k_restarts.mod dimer_utils.mod machine.mod cp_units.mod particle_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="\"Thu Oct 7 17:57:39 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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/motion/gopt_f77_methods.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod gopt_param_types.mod atomic_kind_types.mod cell_types.mod dimer_types.mod gopt_f_types.mod cp_para_types.mod force_env_types.mod virial_types.mod atomic_kind_list_types.mod distribution_1d_types.mod cp_subsys_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod qmmmx_util.mod virial_methods.mod kinds.mod qmmm_util.mod input_constants.mod cp_log_handling.mod motion_utils.mod input_cp2k_restarts.mod dimer_utils.mod machine.mod cp_units.mod particle_methods.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/motion/gopt_f77_methods.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 gopt_param_types.mod gopt_f_types.mod cp_para_types.mod input_section_types.mod force_env_types.mod base_hooks.mod machine.mod cp_log_handling.mod message_passing.mod cp_output_handling.mod cp_lbfgs.mod gopt_f_methods.mod kinds.mod cp_para_env.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="\"Thu Oct 7 17:57:43 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 pint_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/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="\"Thu Oct 7 17:57:45 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:541: update target 'pint_public.mod' due to: pint_public.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/pint_public.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 pint_types.mod parallel_rng_types.mod base_hooks.mod kinds.mod 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 pint_types.mod helium_types.mod splines_types.mod base_hooks.mod mathconstants.mod input_constants.mod memory_utilities.mod pint_public.mod splines_methods.mod kinds.mod physcon.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="\"Thu Oct 7 17:57:46 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pint_types.mod helium_types.mod splines_types.mod base_hooks.mod mathconstants.mod input_constants.mod memory_utilities.mod pint_public.mod splines_methods.mod kinds.mod physcon.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 pint_types.mod helium_types.mod splines_types.mod base_hooks.mod input_constants.mod helium_common.mod kinds.mod physcon.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="\"Thu Oct 7 17:57:52 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 extended_system_types.mod cell_types.mod barostat_types.mod simpar_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod machine.mod cp_output_handling.mod kinds.mod physcon.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="\"Thu Oct 7 17:57:54 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 extended_system_types.mod cell_types.mod barostat_types.mod simpar_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod machine.mod cp_output_handling.mod kinds.mod physcon.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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_units.mod cp_output_handling.mod bibliography.mod kinds.mod input_cp2k_subsys.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="\"Thu Oct 7 17:57:55 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_units.mod cp_output_handling.mod bibliography.mod kinds.mod input_cp2k_subsys.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_section_types.mod barostat_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod cp_units.mod input_cp2k_thermostats.mod cp_output_handling.mod kinds.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="\"Thu Oct 7 17:57:56 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_section_types.mod barostat_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod cp_units.mod input_cp2k_thermostats.mod cp_output_handling.mod kinds.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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod input_cp2k_barostats.mod cp_units.mod input_cp2k_thermostats.mod cp_output_handling.mod bibliography.mod kinds.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="\"Thu Oct 7 17:57:57 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod input_cp2k_barostats.mod cp_units.mod input_cp2k_thermostats.mod cp_output_handling.mod bibliography.mod kinds.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 particle_types.mod atomic_kind_types.mod thermostat_types.mod cell_types.mod qmmm_types_low.mod cp_para_types.mod force_env_types.mod md_environment_types.mod md_ener_types.mod qmmm_types.mod atomic_kind_list_types.mod shell_potential_types.mod distribution_1d_types.mod cp_subsys_types.mod extended_system_types.mod particle_list_types.mod qmmmx_types.mod input_section_types.mod simpar_types.mod base_hooks.mod barostat_utils.mod kinds.mod input_constants.mod message_passing.mod physcon.mod mathconstants.mod thermostat_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="\"Thu Oct 7 17:57:59 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod thermostat_types.mod cell_types.mod qmmm_types_low.mod cp_para_types.mod force_env_types.mod md_environment_types.mod md_ener_types.mod qmmm_types.mod atomic_kind_list_types.mod shell_potential_types.mod distribution_1d_types.mod cp_subsys_types.mod extended_system_types.mod particle_list_types.mod qmmmx_types.mod input_section_types.mod simpar_types.mod base_hooks.mod barostat_utils.mod kinds.mod input_constants.mod message_passing.mod physcon.mod mathconstants.mod thermostat_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 particle_list_types.mod force_env_types.mod thermal_region_types.mod input_section_types.mod cp_subsys_types.mod simpar_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_log_handling.mod memory_utilities.mod cp_output_handling.mod bibliography.mod kinds.mod physcon.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="\"Thu Oct 7 17:58:02 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_list_types.mod force_env_types.mod thermal_region_types.mod input_section_types.mod cp_subsys_types.mod simpar_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_log_handling.mod memory_utilities.mod cp_output_handling.mod bibliography.mod kinds.mod physcon.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 input_enumeration_types.mod atomic_kind_types.mod thermostat_types.mod cell_types.mod reftraj_types.mod thermal_region_types.mod cp_para_types.mod force_env_types.mod input_keyword_types.mod virial_types.mod md_environment_types.mod md_ener_types.mod atomic_kind_list_types.mod qmmm_types.mod barostat_types.mod cp_subsys_types.mod averages_types.mod particle_list_types.mod input_section_types.mod simpar_types.mod base_hooks.mod barostat_utils.mod input_cp2k_md.mod kinds.mod input_constants.mod cp_log_handling.mod motion_utils.mod md_conserved_quantities.mod physcon.mod qs_linres_polar_utils.mod cp_output_handling.mod thermostat_utils.mod thermal_region_utils.mod machine.mod cp_units.mod particle_methods.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="\"Thu Oct 7 17:58:04 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_enumeration_types.mod atomic_kind_types.mod thermostat_types.mod cell_types.mod reftraj_types.mod thermal_region_types.mod cp_para_types.mod force_env_types.mod input_keyword_types.mod virial_types.mod md_environment_types.mod md_ener_types.mod atomic_kind_list_types.mod qmmm_types.mod barostat_types.mod cp_subsys_types.mod averages_types.mod particle_list_types.mod input_section_types.mod simpar_types.mod base_hooks.mod barostat_utils.mod input_cp2k_md.mod kinds.mod input_constants.mod cp_log_handling.mod motion_utils.mod md_conserved_quantities.mod physcon.mod qs_linres_polar_utils.mod cp_output_handling.mod thermostat_utils.mod thermal_region_utils.mod machine.mod cp_units.mod particle_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 md_environment_types.mod cp_para_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod md_energies.mod message_passing.mod cp_output_handling.mod kinds.mod cp_files.mod input_cp2k_restarts.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="\"Thu Oct 7 17:58:09 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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="\"Thu Oct 7 17:58:11 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 md_environment_types.mod md_ener_types.mod force_env_types.mod mdctrl_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/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="\"Thu Oct 7 17:58:11 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 pint_types.mod input_section_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/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="\"Thu Oct 7 17:58:13 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pint_types.mod input_section_types.mod parallel_rng_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 pint_types.mod particle_list_types.mod force_env_types.mod cell_types.mod input_section_types.mod cp_subsys_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod machine.mod pint_transformations.mod cp_units.mod f77_interface.mod particle_methods.mod cp_output_handling.mod pint_public.mod kinds.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="\"Thu Oct 7 17:58:14 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pint_types.mod particle_list_types.mod force_env_types.mod cell_types.mod input_section_types.mod cp_subsys_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod machine.mod pint_transformations.mod cp_units.mod f77_interface.mod particle_methods.mod cp_output_handling.mod pint_public.mod kinds.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 pint_types.mod cp_para_types.mod input_section_types.mod parallel_rng_types.mod pint_io.mod fft_tools.mod base_hooks.mod input_constants.mod cp_log_handling.mod mathconstants.mod message_passing.mod fft_plan.mod cp_output_handling.mod kinds.mod fft_lib.mod cp_files.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="\"Thu Oct 7 17:58:17 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pint_types.mod cp_para_types.mod input_section_types.mod parallel_rng_types.mod pint_io.mod fft_tools.mod base_hooks.mod input_constants.mod cp_log_handling.mod mathconstants.mod message_passing.mod fft_plan.mod cp_output_handling.mod kinds.mod fft_lib.mod cp_files.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 extended_system_types.mod particle_types.mod molecule_kind_types.mod thermostat_types.mod molecule_types.mod cp_para_types.mod input_section_types.mod distribution_1d_types.mod gle_system_types.mod simpar_types.mod parallel_rng_types.mod base_hooks.mod input_constants.mod message_passing.mod thermostat_mapping.mod thermostat_utils.mod kinds.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="\"Thu Oct 7 17:58:22 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 extended_system_types.mod particle_types.mod molecule_kind_types.mod thermostat_types.mod molecule_types.mod cp_para_types.mod input_section_types.mod distribution_1d_types.mod gle_system_types.mod simpar_types.mod parallel_rng_types.mod base_hooks.mod input_constants.mod message_passing.mod thermostat_mapping.mod thermostat_utils.mod kinds.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 pint_types.mod gle_system_types.mod base_hooks.mod gle_system_dynamics.mod kinds.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="\"Thu Oct 7 17:58:24 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pint_types.mod gle_system_types.mod base_hooks.mod gle_system_dynamics.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'helium_interactions.mod' due to: helium_interactions.o 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 cell_types.mod cp_para_types.mod pint_types.mod helium_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod kinds.mod cp_parser_methods.mod helium_interactions.mod cp_log_handling.mod input_constants.mod message_passing.mod helium_common.mod physcon.mod memory_utilities.mod cp_output_handling.mod machine.mod cp_units.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="\"Thu Oct 7 17:58:26 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cell_types.mod cp_para_types.mod pint_types.mod helium_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod kinds.mod cp_parser_methods.mod helium_interactions.mod cp_log_handling.mod input_constants.mod message_passing.mod helium_common.mod physcon.mod memory_utilities.mod cp_output_handling.mod machine.mod cp_units.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 pint_types.mod helium_types.mod base_hooks.mod input_constants.mod helium_interactions.mod mathconstants.mod helium_common.mod helium_io.mod kinds.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="\"Thu Oct 7 17:58:31 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pint_types.mod helium_types.mod base_hooks.mod input_constants.mod helium_interactions.mod mathconstants.mod helium_common.mod helium_io.mod kinds.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 splines_types.mod pint_types.mod global_types.mod helium_types.mod base_hooks.mod helium_worm.mod kinds.mod helium_interactions.mod cp_log_handling.mod input_constants.mod message_passing.mod helium_common.mod input_cp2k_restarts.mod physcon.mod cp_output_handling.mod pint_public.mod machine.mod helium_io.mod cp_external_control.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="\"Thu Oct 7 17:58:43 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 splines_types.mod pint_types.mod global_types.mod helium_types.mod base_hooks.mod helium_worm.mod kinds.mod helium_interactions.mod cp_log_handling.mod input_constants.mod message_passing.mod helium_common.mod input_cp2k_restarts.mod physcon.mod cp_output_handling.mod pint_public.mod machine.mod helium_io.mod cp_external_control.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 atomic_kind_types.mod cell_types.mod force_env_types.mod splines_types.mod parallel_rng_types.mod pint_types.mod helium_types.mod cp_subsys_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_files.mod helium_interactions.mod cp_log_handling.mod input_constants.mod message_passing.mod helium_common.mod bibliography.mod splines_methods.mod physcon.mod mathconstants.mod cp_output_handling.mod helium_sampling.mod pint_public.mod f77_interface.mod helium_io.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="\"Thu Oct 7 17:58:52 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 atomic_kind_types.mod cell_types.mod force_env_types.mod splines_types.mod parallel_rng_types.mod pint_types.mod helium_types.mod cp_subsys_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_files.mod helium_interactions.mod cp_log_handling.mod input_constants.mod message_passing.mod helium_common.mod bibliography.mod splines_methods.mod physcon.mod mathconstants.mod cp_output_handling.mod helium_sampling.mod pint_public.mod f77_interface.mod helium_io.mod true /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 qs_wf_history_types.mod cp_control_types.mod force_env_types.mod cp_para_types.mod input_section_types.mod qs_environment_types.mod cp_result_types.mod replica_types.mod cp_subsys_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod f77_interface.mod cp_output_handling.mod kinds.mod cp_files.mod qs_wf_history_methods.mod cp_para_env.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="\"Thu Oct 7 17:59:02 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_wf_history_types.mod cp_control_types.mod force_env_types.mod cp_para_types.mod input_section_types.mod qs_environment_types.mod cp_result_types.mod replica_types.mod cp_subsys_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod f77_interface.mod cp_output_handling.mod kinds.mod cp_files.mod qs_wf_history_methods.mod cp_para_env.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 pint_types.mod cp_para_types.mod input_section_types.mod parallel_rng_types.mod pint_io.mod base_hooks.mod input_constants.mod message_passing.mod cp_units.mod gle_system_dynamics.mod kinds.mod cp_files.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="\"Thu Oct 7 17:59:05 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pint_types.mod cp_para_types.mod input_section_types.mod parallel_rng_types.mod pint_io.mod base_hooks.mod input_constants.mod message_passing.mod cp_units.mod gle_system_dynamics.mod kinds.mod cp_files.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 particle_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod gle_system_types.mod replica_types.mod cp_para_types.mod force_env_types.mod parallel_rng_types.mod pint_types.mod global_types.mod molecule_kind_types.mod molecule_kind_list_types.mod atomic_kind_list_types.mod distribution_1d_types.mod helium_types.mod cp_subsys_types.mod molecule_list_types.mod particle_list_types.mod input_section_types.mod simpar_types.mod base_hooks.mod pint_pile.mod pint_qtb.mod pint_staging.mod kinds.mod pint_gle.mod constraint_util.mod helium_methods.mod helium_interactions.mod cp_log_handling.mod input_constants.mod message_passing.mod bibliography.mod input_cp2k_restarts.mod pint_io.mod mathconstants.mod pint_transformations.mod cp_output_handling.mod pint_normalmode.mod helium_sampling.mod pint_public.mod constraint.mod mathlib.mod machine.mod cp_units.mod f77_interface.mod replica_methods.mod gle_system_dynamics.mod pint_piglet.mod helium_io.mod cp_external_control.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="\"Thu Oct 7 17:59:09 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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/motion/gopt_f77_methods.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 gopt_param_types.mod atomic_kind_types.mod cell_types.mod gopt_f_types.mod cp_para_types.mod cp_fm_types.mod force_env_types.mod global_types.mod atomic_kind_list_types.mod cp_subsys_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod cp_files.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod gopt_f_methods.mod cp_fm_basic_linalg.mod cp_output_handling.mod cp_fm_diag.mod machine.mod constraint_fxd.mod cp_external_control.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="\"Thu Oct 7 17:59:24 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 particle_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod rt_propagation_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod cp_fm_vect.mod kinds.mod input_constants.mod cp_log_handling.mod qs_mo_io.mod qs_overlap.mod mathconstants.mod cp_fm_basic_linalg.mod orbital_pointers.mod qs_dftb_matrices.mod qs_rho_methods.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="\"Thu Oct 7 17:59:29 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod rt_propagation_types.mod cp_para_types.mod cp_fm_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_mo_methods.mod cp_fm_vect.mod kinds.mod input_constants.mod cp_log_handling.mod qs_mo_io.mod qs_overlap.mod mathconstants.mod cp_fm_basic_linalg.mod orbital_pointers.mod qs_dftb_matrices.mod qs_rho_methods.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 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/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="\"Thu Oct 7 17:59:33 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 base_hooks.mod cp_log_handling.mod kinds.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 input_constants.mod cp_fm_vect.mod ls_matrix_exp.mod matrix_exp.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/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="\"Thu Oct 7 17:59:34 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_constants.mod cp_fm_vect.mod ls_matrix_exp.mod matrix_exp.mod kinds.mod cp_dbcsr_operations.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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod qs_subsys_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod rt_propagation_types.mod qs_linres_types.mod cp_fm_types.mod qs_rho_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod rt_propagation_utils.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod qs_scf_post_tb.mod input_constants.mod cp_log_handling.mod message_passing.mod kahan_sum.mod qs_mo_io.mod qs_scf_post_gpw.mod pw_methods.mod qs_linres_current.mod cp_fm_basic_linalg.mod cp_output_handling.mod cp_realspace_grid_cube.mod machine.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_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="\"Thu Oct 7 17:59:35 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod pw_pool_types.mod pw_types.mod qs_subsys_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod rt_propagation_types.mod qs_linres_types.mod cp_fm_types.mod qs_rho_types.mod qs_environment_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod rt_propagation_utils.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod qs_scf_post_tb.mod input_constants.mod cp_log_handling.mod message_passing.mod kahan_sum.mod qs_mo_io.mod qs_scf_post_gpw.mod pw_methods.mod qs_linres_current.mod cp_fm_basic_linalg.mod cp_output_handling.mod cp_realspace_grid_cube.mod machine.mod cp_dbcsr_operations.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_cfm_types.mod cp_control_types.mod rt_propagation_types.mod cp_fm_types.mod qs_environment_types.mod qs_energy_types.mod base_hooks.mod rt_propagation_utils.mod cp_fm_vect.mod qs_ks_methods.mod cp_dbcsr_cholesky.mod cp_fm_struct.mod kinds.mod cp_cfm_basic_linalg.mod rt_make_propagators.mod iterate_matrix.mod input_constants.mod cp_log_handling.mod qs_energy_init.mod bibliography.mod cp_fm_basic_linalg.mod mathlib.mod rt_propagation_output.mod ls_matrix_exp.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="\"Thu Oct 7 17:59:40 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_cfm_types.mod cp_control_types.mod rt_propagation_types.mod cp_fm_types.mod qs_environment_types.mod qs_energy_types.mod base_hooks.mod rt_propagation_utils.mod cp_fm_vect.mod qs_ks_methods.mod cp_dbcsr_cholesky.mod cp_fm_struct.mod kinds.mod cp_cfm_basic_linalg.mod rt_make_propagators.mod iterate_matrix.mod input_constants.mod cp_log_handling.mod qs_energy_init.mod bibliography.mod cp_fm_basic_linalg.mod mathlib.mod rt_propagation_output.mod ls_matrix_exp.mod cp_dbcsr_operations.mod 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/motion/gopt_f77_methods.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 global_types.mod gopt_param_types.mod gopt_f_types.mod cp_para_types.mod dimer_types.mod base_hooks.mod input_constants.mod mathconstants.mod memory_utilities.mod dimer_utils.mod cp_external_control.mod kinds.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="\"Thu Oct 7 17:59:44 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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/motion/gopt_f77_methods.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 global_types.mod gopt_param_types.mod gopt_f_types.mod cp_para_types.mod dimer_types.mod base_hooks.mod input_constants.mod mathconstants.mod memory_utilities.mod dimer_utils.mod cp_external_control.mod kinds.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/motion/gopt_f77_methods.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 global_types.mod gopt_param_types.mod cell_types.mod gopt_f_types.mod input_section_types.mod cp_para_types.mod force_env_types.mod base_hooks.mod machine.mod cp_log_handling.mod cp_output_handling.mod gopt_f_methods.mod cp_external_control.mod kinds.mod cg_utils.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="\"Thu Oct 7 17:59:49 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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/motion/gopt_f77_methods.f90 /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 global_types.mod gopt_param_types.mod cell_types.mod gopt_f_types.mod input_section_types.mod cp_para_types.mod force_env_types.mod base_hooks.mod machine.mod cp_log_handling.mod cp_output_handling.mod gopt_f_methods.mod cp_external_control.mod kinds.mod cg_utils.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 particle_types.mod atomic_kind_types.mod thermostat_types.mod molecule_types.mod cell_types.mod cp_para_types.mod molecule_kind_types.mod virial_types.mod md_environment_types.mod shell_potential_types.mod barostat_types.mod distribution_1d_types.mod extended_system_types.mod simpar_types.mod base_hooks.mod kinds.mod constraint_util.mod input_constants.mod message_passing.mod constraint.mod mathlib.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="\"Thu Oct 7 17:59:52 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod thermostat_types.mod molecule_types.mod cell_types.mod cp_para_types.mod molecule_kind_types.mod virial_types.mod md_environment_types.mod shell_potential_types.mod barostat_types.mod distribution_1d_types.mod extended_system_types.mod simpar_types.mod base_hooks.mod kinds.mod constraint_util.mod input_constants.mod message_passing.mod constraint.mod mathlib.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 particle_types.mod gopt_param_types.mod atomic_kind_types.mod gopt_f_types.mod cp_para_types.mod force_env_types.mod global_types.mod atomic_kind_list_types.mod shell_potential_types.mod distribution_1d_types.mod cp_subsys_types.mod input_section_types.mod base_hooks.mod cg_optimizer.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod cp_output_handling.mod integrator_utils.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="\"Thu Oct 7 17:59:58 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod gopt_param_types.mod atomic_kind_types.mod gopt_f_types.mod cp_para_types.mod force_env_types.mod global_types.mod atomic_kind_list_types.mod shell_potential_types.mod distribution_1d_types.mod cp_subsys_types.mod input_section_types.mod base_hooks.mod cg_optimizer.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod cp_output_handling.mod integrator_utils.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 qmmmx_types.mod qmmm_types.mod atomic_kind_list_types.mod input_section_types.mod distribution_1d_types.mod force_env_types.mod cp_subsys_types.mod base_hooks.mod qmmmx_util.mod input_restart_force_eval.mod qmmm_create.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="\"Thu Oct 7 18:00:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qmmmx_types.mod qmmm_types.mod atomic_kind_list_types.mod input_section_types.mod distribution_1d_types.mod force_env_types.mod cp_subsys_types.mod base_hooks.mod qmmmx_util.mod input_restart_force_eval.mod qmmm_create.mod 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 extended_system_types.mod csvr_system_types.mod molecule_kind_types.mod thermostat_types.mod molecule_types.mod cp_para_types.mod distribution_1d_types.mod simpar_types.mod base_hooks.mod input_constants.mod message_passing.mod thermostat_mapping.mod kinds.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="\"Thu Oct 7 18:00:02 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 extended_system_types.mod csvr_system_types.mod molecule_kind_types.mod thermostat_types.mod molecule_types.mod cp_para_types.mod distribution_1d_types.mod simpar_types.mod base_hooks.mod input_constants.mod message_passing.mod thermostat_mapping.mod kinds.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 csvr_system_types.mod molecule_kind_types.mod thermostat_types.mod molecule_types.mod cp_para_types.mod input_section_types.mod distribution_1d_types.mod simpar_types.mod parallel_rng_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="\"Thu Oct 7 18:00:03 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 csvr_system_types.mod molecule_kind_types.mod thermostat_types.mod molecule_types.mod cp_para_types.mod input_section_types.mod distribution_1d_types.mod simpar_types.mod parallel_rng_types.mod base_hooks.mod csvr_system_mapping.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 extended_system_types.mod molecule_kind_types.mod al_system_types.mod thermostat_types.mod molecule_types.mod cp_para_types.mod distribution_1d_types.mod simpar_types.mod base_hooks.mod input_constants.mod message_passing.mod thermostat_mapping.mod kinds.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="\"Thu Oct 7 18:00:03 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 extended_system_types.mod molecule_kind_types.mod al_system_types.mod thermostat_types.mod molecule_types.mod cp_para_types.mod distribution_1d_types.mod simpar_types.mod base_hooks.mod input_constants.mod message_passing.mod thermostat_mapping.mod kinds.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 molecule_kind_types.mod al_system_types.mod thermostat_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod distribution_1d_types.mod simpar_types.mod base_hooks.mod al_system_mapping.mod kinds.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="\"Thu Oct 7 18:00:04 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 molecule_kind_types.mod al_system_types.mod thermostat_types.mod molecule_types.mod input_section_types.mod cp_para_types.mod distribution_1d_types.mod simpar_types.mod base_hooks.mod al_system_mapping.mod kinds.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 extended_system_types.mod particle_types.mod molecule_kind_types.mod al_system_types.mod atomic_kind_types.mod molecule_types.mod distribution_1d_types.mod force_env_types.mod base_hooks.mod constraint_fxd.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/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="\"Thu Oct 7 18:00:04 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 extended_system_types.mod particle_types.mod molecule_kind_types.mod al_system_types.mod atomic_kind_types.mod molecule_types.mod distribution_1d_types.mod force_env_types.mod base_hooks.mod constraint_fxd.mod kinds.mod thermostat_utils.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="\"Thu Oct 7 18:00:06 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 extended_system_types.mod particle_types.mod csvr_system_types.mod molecule_kind_types.mod atomic_kind_types.mod molecule_types.mod distribution_1d_types.mod parallel_rng_types.mod base_hooks.mod csvr_system_utils.mod thermostat_utils.mod kinds.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="\"Thu Oct 7 18:00:06 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 extended_system_types.mod particle_types.mod csvr_system_types.mod molecule_kind_types.mod atomic_kind_types.mod molecule_types.mod distribution_1d_types.mod parallel_rng_types.mod base_hooks.mod csvr_system_utils.mod thermostat_utils.mod kinds.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 extended_system_types.mod particle_types.mod molecule_kind_types.mod atomic_kind_types.mod molecule_types.mod shell_potential_types.mod distribution_1d_types.mod base_hooks.mod thermostat_utils.mod kinds.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="\"Thu Oct 7 18:00:07 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 extended_system_types.mod particle_types.mod molecule_kind_types.mod atomic_kind_types.mod molecule_types.mod shell_potential_types.mod distribution_1d_types.mod base_hooks.mod thermostat_utils.mod kinds.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 particle_types.mod atomic_kind_types.mod thermostat_types.mod molecule_types.mod cell_types.mod cp_para_types.mod force_env_types.mod global_types.mod molecule_kind_types.mod molecule_kind_list_types.mod atomic_kind_list_types.mod qmmm_types.mod distribution_1d_types.mod cp_subsys_types.mod molecule_list_types.mod simpar_types.mod extended_system_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod csvr_system_init.mod kinds.mod input_constants.mod al_system_init.mod cp_log_handling.mod bibliography.mod cp_output_handling.mod thermostat_utils.mod cp_units.mod al_system_dynamics.mod extended_system_init.mod gle_system_dynamics.mod csvr_system_dynamics.mod extended_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="\"Thu Oct 7 18:00:09 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod thermostat_types.mod molecule_types.mod cell_types.mod cp_para_types.mod force_env_types.mod global_types.mod molecule_kind_types.mod molecule_kind_list_types.mod atomic_kind_list_types.mod qmmm_types.mod distribution_1d_types.mod cp_subsys_types.mod molecule_list_types.mod simpar_types.mod extended_system_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod csvr_system_init.mod kinds.mod input_constants.mod al_system_init.mod cp_log_handling.mod bibliography.mod cp_output_handling.mod thermostat_utils.mod cp_units.mod al_system_dynamics.mod extended_system_init.mod gle_system_dynamics.mod csvr_system_dynamics.mod extended_system_dynamics.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 particle_types.mod atomic_kind_types.mod molecule_types.mod reftraj_types.mod cp_para_types.mod force_env_types.mod molecule_kind_types.mod molecule_kind_list_types.mod md_environment_types.mod atomic_kind_list_types.mod distribution_1d_types.mod cp_subsys_types.mod molecule_list_types.mod particle_list_types.mod input_section_types.mod simpar_types.mod base_hooks.mod kinds.mod cp_files.mod cp_parser_methods.mod util.mod cp_log_handling.mod message_passing.mod physcon.mod cp_output_handling.mod machine.mod cp_units.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="\"Thu Oct 7 18:00:13 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:541: update target 'reftraj_util.mod' due to: reftraj_util.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/reftraj_util.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod atomic_kind_types.mod molecule_types.mod reftraj_types.mod cp_para_types.mod force_env_types.mod molecule_kind_types.mod molecule_kind_list_types.mod md_environment_types.mod atomic_kind_list_types.mod distribution_1d_types.mod cp_subsys_types.mod molecule_list_types.mod particle_list_types.mod input_section_types.mod simpar_types.mod base_hooks.mod kinds.mod cp_files.mod cp_parser_methods.mod util.mod cp_log_handling.mod message_passing.mod physcon.mod cp_output_handling.mod machine.mod cp_units.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 cell_types.mod force_env_types.mod metadynamics_types.mod colvar_types.mod cp_subsys_types.mod particle_list_types.mod input_section_types.mod simpar_types.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod bibliography.mod physcon.mod cp_output_handling.mod reference_manager.mod metadynamics_utils.mod colvar_methods.mod constraint_fxd.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="\"Thu Oct 7 18:00:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cell_types.mod force_env_types.mod metadynamics_types.mod colvar_types.mod cp_subsys_types.mod particle_list_types.mod input_section_types.mod simpar_types.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod bibliography.mod physcon.mod cp_output_handling.mod reference_manager.mod metadynamics_utils.mod colvar_methods.mod constraint_fxd.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 particle_types.mod atomic_kind_types.mod thermostat_types.mod molecule_types.mod cell_types.mod reftraj_types.mod cp_control_types.mod thermal_region_types.mod rt_propagation_types.mod cp_para_types.mod force_env_types.mod global_types.mod molecule_kind_types.mod virial_types.mod molecule_kind_list_types.mod md_environment_types.mod atomic_kind_list_types.mod barostat_types.mod distribution_1d_types.mod qs_environment_types.mod cp_subsys_types.mod molecule_list_types.mod simpar_types.mod extended_system_types.mod particle_list_types.mod base_hooks.mod virial_methods.mod kinds.mod rt_propagation_methods.mod cp_parser_methods.mod constraint_util.mod shell_opt.mod qmmmx_update.mod qmmm_util.mod input_constants.mod cp_log_handling.mod thermostat_methods.mod physcon.mod force_env_methods.mod constraint.mod integrator_utils.mod reftraj_util.mod eigenvalueproblems.mod mathlib.mod rt_propagation_output.mod cp_units.mod metadynamics.mod constraint_fxd.mod extended_system_dynamics.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="\"Thu Oct 7 18:00:19 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod thermostat_types.mod molecule_types.mod cell_types.mod reftraj_types.mod cp_control_types.mod thermal_region_types.mod rt_propagation_types.mod cp_para_types.mod force_env_types.mod global_types.mod molecule_kind_types.mod virial_types.mod molecule_kind_list_types.mod md_environment_types.mod atomic_kind_list_types.mod barostat_types.mod distribution_1d_types.mod qs_environment_types.mod cp_subsys_types.mod molecule_list_types.mod simpar_types.mod extended_system_types.mod particle_list_types.mod base_hooks.mod virial_methods.mod kinds.mod rt_propagation_methods.mod cp_parser_methods.mod constraint_util.mod shell_opt.mod qmmmx_update.mod qmmm_util.mod input_constants.mod cp_log_handling.mod thermostat_methods.mod physcon.mod force_env_methods.mod constraint.mod integrator_utils.mod reftraj_util.mod eigenvalueproblems.mod mathlib.mod rt_propagation_output.mod cp_units.mod metadynamics.mod constraint_fxd.mod extended_system_dynamics.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 global_types.mod md_environment_types.mod force_env_types.mod simpar_types.mod base_hooks.mod integrator.mod input_constants.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="\"Thu Oct 7 18:00:28 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 global_types.mod md_environment_types.mod force_env_types.mod simpar_types.mod base_hooks.mod integrator.mod input_constants.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'md_util.mod' due to: md_util.o 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 md_environment_types.mod particle_list_types.mod atomic_kind_list_types.mod cp_para_types.mod input_section_types.mod distribution_1d_types.mod force_env_types.mod metadynamics_types.mod simpar_types.mod parallel_rng_types.mod cp_subsys_types.mod base_hooks.mod string_utilities.mod kinds.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="\"Thu Oct 7 18:00:29 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 md_environment_types.mod particle_list_types.mod atomic_kind_list_types.mod cp_para_types.mod input_section_types.mod distribution_1d_types.mod force_env_types.mod metadynamics_types.mod simpar_types.mod parallel_rng_types.mod cp_subsys_types.mod base_hooks.mod string_utilities.mod kinds.mod true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'glbopt_callback.mod' due to: glbopt_callback.o 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 base_hooks.mod glbopt_callback.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="\"Thu Oct 7 18:00:31 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 base_hooks.mod glbopt_callback.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 cp_control_types.mod qs_neighbor_list_types.mod rt_propagation_types.mod qs_rho_types.mod qs_environment_types.mod qs_ks_types.mod base_hooks.mod kinds.mod cp_dbcsr_operations.mod cp_dbcsr_cp2k_link.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="\"Thu Oct 7 18:00:32 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_control_types.mod qs_neighbor_list_types.mod rt_propagation_types.mod qs_rho_types.mod qs_environment_types.mod qs_ks_types.mod base_hooks.mod kinds.mod cp_dbcsr_operations.mod cp_dbcsr_cp2k_link.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 cp_cfm_types.mod particle_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod rt_propagation_types.mod cp_fm_types.mod qs_environment_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod cp_cfm_diag.mod cp_fm_cholesky.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_cfm_basic_linalg.mod cp_dbcsr_cp2k_link.mod commutator_rpnl.mod mathconstants.mod qs_moments.mod cp_fm_basic_linalg.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/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="\"Thu Oct 7 18:00:34 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_cfm_types.mod particle_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod rt_propagation_types.mod cp_fm_types.mod qs_environment_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod cp_cfm_diag.mod cp_fm_cholesky.mod cp_fm_struct.mod cp_gemm_interface.mod kinds.mod cp_cfm_basic_linalg.mod cp_dbcsr_cp2k_link.mod commutator_rpnl.mod mathconstants.mod qs_moments.mod cp_fm_basic_linalg.mod cp_fm_diag.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_control_types.mod rt_propagation_types.mod cp_fm_types.mod qs_environment_types.mod qs_mo_types.mod base_hooks.mod arnoldi_api.mod cp_gemm_interface.mod kinds.mod rt_make_propagators.mod rt_propagation_methods.mod iterate_matrix.mod input_constants.mod cp_log_handling.mod cp_fm_basic_linalg.mod matrix_exp.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/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="\"Thu Oct 7 18:00:37 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_control_types.mod rt_propagation_types.mod cp_fm_types.mod qs_environment_types.mod qs_mo_types.mod base_hooks.mod arnoldi_api.mod cp_gemm_interface.mod kinds.mod rt_make_propagators.mod rt_propagation_methods.mod iterate_matrix.mod input_constants.mod cp_log_handling.mod cp_fm_basic_linalg.mod matrix_exp.mod cp_fm_diag.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 pw_env_types.mod cp_control_types.mod rt_propagation_types.mod cp_fm_pool_types.mod cp_fm_types.mod force_env_types.mod qs_ks_types.mod global_types.mod md_environment_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod rt_propagation_utils.mod qs_ks_methods.mod kinds.mod rt_hfx_utils.mod rt_propagation_methods.mod rt_delta_pulse.mod input_constants.mod cp_log_handling.mod qs_energy_init.mod bibliography.mod input_cp2k_restarts.mod rt_propagator_init.mod force_env_methods.mod qs_matrix_pools.mod cp_output_handling.mod qs_external_potential.mod machine.mod rt_propagation_output.mod qs_dftb_matrices.mod cp_external_control.mod efield_utils.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="\"Thu Oct 7 18:00:40 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 pw_env_types.mod cp_control_types.mod rt_propagation_types.mod cp_fm_pool_types.mod cp_fm_types.mod force_env_types.mod qs_ks_types.mod global_types.mod md_environment_types.mod qs_environment_types.mod qs_energy_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod rt_propagation_utils.mod qs_ks_methods.mod kinds.mod rt_hfx_utils.mod rt_propagation_methods.mod rt_delta_pulse.mod input_constants.mod cp_log_handling.mod qs_energy_init.mod bibliography.mod input_cp2k_restarts.mod rt_propagator_init.mod force_env_methods.mod qs_matrix_pools.mod cp_output_handling.mod qs_external_potential.mod machine.mod rt_propagation_output.mod qs_dftb_matrices.mod cp_external_control.mod efield_utils.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_enumeration_types.mod input_section_types.mod simpar_types.mod input_keyword_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod cp_units.mod input_cp2k_md.mod cp_output_handling.mod bibliography.mod kinds.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="\"Thu Oct 7 18:00:45 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_enumeration_types.mod input_section_types.mod simpar_types.mod input_keyword_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod cp_units.mod input_cp2k_md.mod cp_output_handling.mod bibliography.mod kinds.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 particle_types.mod atomic_kind_types.mod cell_types.mod thermal_region_types.mod cp_para_types.mod force_env_types.mod parallel_rng_types.mod global_types.mod molecule_kind_types.mod molecule_kind_list_types.mod md_environment_types.mod md_ener_types.mod atomic_kind_list_types.mod shell_potential_types.mod cp_subsys_types.mod extended_system_types.mod input_val_types.mod particle_list_types.mod input_section_types.mod simpar_types.mod base_hooks.mod input_restart_force_eval.mod md_util.mod force_env_utils.mod kinds.mod shell_opt.mod input_constants.mod cp_log_handling.mod bibliography.mod physcon.mod force_env_methods.mod mathconstants.mod cp_output_handling.mod input_cp2k_binary_restarts.mod mathlib.mod cp_units.mod cp_linked_list_input.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="\"Thu Oct 7 18:00:47 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod cell_types.mod thermal_region_types.mod cp_para_types.mod force_env_types.mod parallel_rng_types.mod global_types.mod molecule_kind_types.mod molecule_kind_list_types.mod md_environment_types.mod md_ener_types.mod atomic_kind_list_types.mod shell_potential_types.mod cp_subsys_types.mod extended_system_types.mod input_val_types.mod particle_list_types.mod input_section_types.mod simpar_types.mod base_hooks.mod input_restart_force_eval.mod md_util.mod force_env_utils.mod kinds.mod shell_opt.mod input_constants.mod cp_log_handling.mod bibliography.mod physcon.mod force_env_methods.mod mathconstants.mod cp_output_handling.mod input_cp2k_binary_restarts.mod mathlib.mod cp_units.mod cp_linked_list_input.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 cp_log_handling.mod kinds.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="\"Thu Oct 7 18:00:54 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_log_handling.mod kinds.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 md_environment_types.mod force_env_types.mod free_energy_types.mod input_section_types.mod cp_subsys_types.mod simpar_types.mod base_hooks.mod mathlib.mod string_utilities.mod input_constants.mod cp_log_handling.mod memory_utilities.mod cp_output_handling.mod statistical_methods.mod colvar_methods.mod kinds.mod fparser.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="\"Thu Oct 7 18:00:55 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 md_environment_types.mod force_env_types.mod free_energy_types.mod input_section_types.mod cp_subsys_types.mod simpar_types.mod base_hooks.mod mathlib.mod string_utilities.mod input_constants.mod cp_log_handling.mod memory_utilities.mod cp_output_handling.mod statistical_methods.mod colvar_methods.mod kinds.mod fparser.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 thermostat_types.mod cell_types.mod reftraj_types.mod thermal_region_types.mod cp_para_types.mod force_env_types.mod metadynamics_types.mod global_types.mod virial_types.mod md_environment_types.mod md_ener_types.mod atomic_kind_list_types.mod barostat_types.mod distribution_1d_types.mod cp_subsys_types.mod averages_types.mod particle_list_types.mod free_energy_types.mod mdctrl_types.mod input_section_types.mod simpar_types.mod base_hooks.mod md_energies.mod velocity_verlet_control.mod md_util.mod virial_methods.mod wiener_process.mod kinds.mod input_cp2k_check.mod input_constants.mod cp_log_handling.mod mdctrl_methods.mod rt_propagation.mod thermostat_methods.mod simpar_methods.mod force_env_methods.mod md_vel_utils.mod cp_output_handling.mod reftraj_util.mod qs_environment_methods.mod thermal_region_utils.mod machine.mod metadynamics.mod cp_external_control.mod free_energy_methods.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="\"Thu Oct 7 18:01:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 global_types.mod particle_types.mod neb_types.mod input_section_types.mod base_hooks.mod input_constants.mod cp_units.mod kinds.mod physcon.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="\"Thu Oct 7 18:01:05 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 global_types.mod particle_types.mod neb_types.mod input_section_types.mod base_hooks.mod input_constants.mod cp_units.mod kinds.mod physcon.mod true /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: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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_units.mod input_cp2k_thermostats.mod cp_output_handling.mod bibliography.mod kinds.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="\"Thu Oct 7 18:01:07 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_units.mod input_cp2k_thermostats.mod cp_output_handling.mod bibliography.mod kinds.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 particle_types.mod input_enumeration_types.mod neb_types.mod cell_types.mod replica_types.mod force_env_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod neb_md_utils.mod kinds.mod cp_files.mod header.mod input_constants.mod cp_log_handling.mod input_cp2k_restarts.mod cp2k_info.mod physcon.mod input_cp2k_neb.mod cp_output_handling.mod machine.mod cp_units.mod f77_interface.mod particle_methods.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="\"Thu Oct 7 18:01:08 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 'neb_io.mod' due to: neb_io.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_io.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod input_enumeration_types.mod neb_types.mod cell_types.mod replica_types.mod force_env_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod neb_md_utils.mod kinds.mod cp_files.mod header.mod input_constants.mod cp_log_handling.mod input_cp2k_restarts.mod cp2k_info.mod physcon.mod input_cp2k_neb.mod cp_output_handling.mod machine.mod cp_units.mod f77_interface.mod particle_methods.mod 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:541: update target 'cp_lbfgs_optimizer_gopt.mod' due to: cp_lbfgs_optimizer_gopt.o 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 global_types.mod gopt_param_types.mod cell_types.mod gopt_f_types.mod cp_para_types.mod input_section_types.mod force_env_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod cp_lbfgs_optimizer_gopt.mod cp_output_handling.mod gopt_f_methods.mod cp_external_control.mod kinds.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="\"Thu Oct 7 18:01:11 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 global_types.mod gopt_param_types.mod cell_types.mod gopt_f_types.mod cp_para_types.mod input_section_types.mod force_env_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod cp_lbfgs_optimizer_gopt.mod cp_output_handling.mod gopt_f_methods.mod cp_external_control.mod kinds.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 global_types.mod gopt_param_types.mod gopt_f_types.mod input_section_types.mod force_env_types.mod base_hooks.mod bfgs_optimizer.mod cp_lbfgs_geo.mod cp_log_handling.mod cg_optimizer.mod input_constants.mod cp_output_handling.mod gopt_f_methods.mod kinds.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="\"Thu Oct 7 18:01:13 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 global_types.mod gopt_param_types.mod gopt_f_types.mod input_section_types.mod force_env_types.mod base_hooks.mod bfgs_optimizer.mod cp_lbfgs_geo.mod cp_log_handling.mod cg_optimizer.mod input_constants.mod cp_output_handling.mod gopt_f_methods.mod kinds.mod 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 particle_types.mod neb_types.mod replica_types.mod cp_para_types.mod force_env_types.mod global_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod neb_md_utils.mod kinds.mod cp_parser_methods.mod input_cp2k_check.mod input_constants.mod cp_log_handling.mod bibliography.mod physcon.mod force_env_methods.mod cp_output_handling.mod rmsd.mod colvar_utils.mod mathlib.mod f77_interface.mod replica_methods.mod md_run.mod neb_io.mod geo_opt.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="\"Thu Oct 7 18:01:15 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 global_types.mod gopt_param_types.mod gopt_f_types.mod input_section_types.mod force_env_types.mod base_hooks.mod bfgs_optimizer.mod cp_lbfgs_geo.mod cp_log_handling.mod cg_optimizer.mod input_constants.mod cp_output_handling.mod gopt_f_methods.mod kinds.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="\"Thu Oct 7 18:01:23 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 'neb_utils.mod' due to: neb_utils.o 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 particle_types.mod neb_types.mod input_section_types.mod replica_types.mod base_hooks.mod cp_log_handling.mod neb_utils.mod kinds.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="\"Thu Oct 7 18:01:26 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:541: update target 'neb_opt_utils.mod' due to: neb_opt_utils.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/neb_opt_utils.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod neb_types.mod input_section_types.mod replica_types.mod base_hooks.mod cp_log_handling.mod neb_utils.mod kinds.mod 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 particle_types.mod neb_types.mod replica_types.mod cp_para_types.mod force_env_types.mod global_types.mod cp_subsys_types.mod input_section_types.mod neb_opt_utils.mod neb_md_utils.mod base_hooks.mod kinds.mod header.mod input_constants.mod cp_log_handling.mod neb_utils.mod physcon.mod cp_output_handling.mod colvar_utils.mod f77_interface.mod replica_methods.mod neb_io.mod cp_external_control.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="\"Thu Oct 7 18:01:29 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 particle_list_types.mod force_env_types.mod gopt_f_types.mod input_section_types.mod cp_subsys_types.mod dimer_types.mod force_env_methods.mod base_hooks.mod input_constants.mod cp_log_handling.mod cp_output_handling.mod kinds.mod bibliography.mod dimer_utils.mod geo_opt.mod motion_utils.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="\"Thu Oct 7 18:01:33 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 'dimer_methods.mod' due to: dimer_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/motion/dimer_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_list_types.mod force_env_types.mod gopt_f_types.mod input_section_types.mod cp_subsys_types.mod dimer_types.mod force_env_methods.mod base_hooks.mod input_constants.mod cp_log_handling.mod cp_output_handling.mod kinds.mod bibliography.mod dimer_utils.mod geo_opt.mod motion_utils.mod 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 gopt_f_types.mod cp_para_types.mod force_env_types.mod virial_types.mod cp_subsys_types.mod averages_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod virial_methods.mod kinds.mod cell_opt_utils.mod cp_log_handling.mod input_constants.mod message_passing.mod gopt_f_methods.mod bibliography.mod force_env_methods.mod dimer_methods.mod cell_methods.mod particle_methods.mod md_run.mod geo_opt.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="\"Thu Oct 7 18:01:36 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 global_types.mod particle_types.mod cp_para_types.mod input_section_types.mod replica_types.mod base_hooks.mod molden_utils.mod mathlib.mod input_constants.mod cp_log_handling.mod cp_result_methods.mod message_passing.mod replica_methods.mod cp_output_handling.mod kinds.mod cp_files.mod physcon.mod util.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="\"Thu Oct 7 18:01:39 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 global_types.mod particle_types.mod cp_para_types.mod input_section_types.mod replica_types.mod base_hooks.mod molden_utils.mod mathlib.mod input_constants.mod cp_log_handling.mod cp_result_methods.mod message_passing.mod replica_methods.mod cp_output_handling.mod kinds.mod cp_files.mod physcon.mod util.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 particle_types.mod atomic_kind_types.mod replica_types.mod cp_para_types.mod cp_fm_types.mod force_env_types.mod global_types.mod molecule_kind_types.mod molecule_kind_list_types.mod cp_subsys_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod molden_utils.mod cp_blacs_env.mod cp_fm_struct.mod kinds.mod header.mod util.mod input_constants.mod cp_log_handling.mod motion_utils.mod physcon.mod mathconstants.mod scine_utils.mod cp_output_handling.mod mode_selective.mod grrm_utils.mod cp_result_methods.mod mathlib.mod f77_interface.mod replica_methods.mod particle_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="\"Thu Oct 7 18:01:49 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_units.mod cp_output_handling.mod kinds.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="\"Thu Oct 7 18:01:57 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: cp_lbfgs_optimizer_gopt.o helium_interactions.o input_cp2k_restarts.o neb_types.o md_util.o glbopt_callback.o thermal_region_types.o md_environment_types.o pint_public.o pint_methods.o pint_pile.o thermal_region_utils.o pint_types.o helium_sampling.o dimer_utils.o bfgs_optimizer.o md_run.o cg_optimizer.o neb_utils.o cell_opt.o reftraj_types.o reftraj_util.o neb_methods.o pint_qtb.o dimer_types.o wiener_process.o helium_methods.o rt_propagation.o integrator.o cell_opt_utils.o averages_types.o neb_io.o cp_lbfgs_geo.o simpar_methods.o gopt_f_types.o velocity_verlet_control.o gopt_f77_methods.o helium_worm.o input_cp2k_md.o md_ener_types.o cg_utils.o shell_opt.o cell_opt_types.o pint_transformations.o neb_md_utils.o integrator_utils.o md_energies.o pint_piglet.o pint_io.o geo_opt.o gopt_f_methods.o gopt_param_types.o cp_lbfgs.o neb_opt_utils.o helium_types.o vibrational_analysis.o helium_common.o input_cp2k_vib.o md_vel_utils.o free_energy_methods.o pint_normalmode.o helium_io.o pint_gle.o mdctrl_methods.o dimer_methods.o md_conserved_quantities.o pint_staging.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 cp_lbfgs_optimizer_gopt.o helium_interactions.o input_cp2k_restarts.o neb_types.o md_util.o glbopt_callback.o thermal_region_types.o md_environment_types.o pint_public.o pint_methods.o pint_pile.o thermal_region_utils.o pint_types.o helium_sampling.o dimer_utils.o bfgs_optimizer.o md_run.o cg_optimizer.o neb_utils.o cell_opt.o reftraj_types.o reftraj_util.o neb_methods.o pint_qtb.o dimer_types.o wiener_process.o helium_methods.o rt_propagation.o integrator.o cell_opt_utils.o averages_types.o neb_io.o cp_lbfgs_geo.o simpar_methods.o gopt_f_types.o velocity_verlet_control.o gopt_f77_methods.o helium_worm.o input_cp2k_md.o md_ener_types.o cg_utils.o shell_opt.o cell_opt_types.o pint_transformations.o neb_md_utils.o integrator_utils.o md_energies.o pint_piglet.o pint_io.o geo_opt.o gopt_f_methods.o gopt_param_types.o cp_lbfgs.o neb_opt_utils.o helium_types.o vibrational_analysis.o helium_common.o input_cp2k_vib.o md_vel_utils.o free_energy_methods.o pint_normalmode.o helium_io.o pint_gle.o mdctrl_methods.o dimer_methods.o md_conserved_quantities.o pint_staging.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: al_system_init.o extended_system_dynamics.o barostat_types.o al_system_dynamics.o thermostat_types.o extended_system_mapping.o input_cp2k_barostats.o csvr_system_dynamics.o barostat_utils.o gle_system_dynamics.o csvr_system_mapping.o al_system_mapping.o csvr_system_init.o thermostat_methods.o thermostat_mapping.o thermostat_utils.o extended_system_init.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 al_system_init.o extended_system_dynamics.o barostat_types.o al_system_dynamics.o thermostat_types.o extended_system_mapping.o input_cp2k_barostats.o csvr_system_dynamics.o barostat_utils.o gle_system_dynamics.o csvr_system_mapping.o al_system_mapping.o csvr_system_init.o thermostat_methods.o thermostat_mapping.o thermostat_utils.o extended_system_init.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_delta_pulse.o rt_propagation_output.o rt_hfx_utils.o rt_propagator_init.o rt_propagation_methods.o rt_propagation_utils.o rt_make_propagators.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_delta_pulse.o rt_propagation_output.o rt_hfx_utils.o rt_propagator_init.o rt_propagation_methods.o rt_propagation_utils.o rt_make_propagators.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 '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="\"Thu Oct 7 18:01:58 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:541: update target 'negf_alloc_types.mod' due to: negf_alloc_types.o /build/cp2k-Q381vr/cp2k-8.1/src/negf_alloc_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 '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 particle_types.mod molecule_kind_types.mod molecule_types.mod input_section_types.mod negf_alloc_types.mod cp_subsys_types.mod base_hooks.mod mathconstants.mod input_constants.mod string_utilities.mod kinds.mod physcon.mod util.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="\"Thu Oct 7 18:01:58 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod molecule_kind_types.mod molecule_types.mod input_section_types.mod negf_alloc_types.mod cp_subsys_types.mod base_hooks.mod mathconstants.mod input_constants.mod string_utilities.mod kinds.mod physcon.mod util.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 negf_control_types.mod cp_para_types.mod base_hooks.mod message_passing.mod cp_blacs_env.mod cp_para_env.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="\"Thu Oct 7 18:02:01 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 negf_control_types.mod cp_para_types.mod base_hooks.mod message_passing.mod cp_blacs_env.mod cp_para_env.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 qs_subsys_types.mod particle_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="\"Thu Oct 7 18:02:01 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_subsys_types.mod particle_types.mod base_hooks.mod kinds.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_kind_types.mod particle_types.mod atomic_kind_types.mod cell_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_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="\"Thu Oct 7 18:02:02 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_kind_types.mod particle_types.mod atomic_kind_types.mod cell_types.mod qs_subsys_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 qs_kind_types.mod particle_types.mod qs_subsys_types.mod cp_para_types.mod negf_alloc_types.mod cp_fm_types.mod base_hooks.mod message_passing.mod particle_methods.mod cp_fm_basic_linalg.mod kinds.mod negf_atom_map.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="\"Thu Oct 7 18:02:03 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 qs_kind_types.mod particle_types.mod qs_subsys_types.mod cp_para_types.mod negf_alloc_types.mod cp_fm_types.mod base_hooks.mod message_passing.mod particle_methods.mod cp_fm_basic_linalg.mod kinds.mod negf_atom_map.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 particle_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod force_env_types.mod qs_mo_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod negf_control_types.mod qs_density_mixing_types.mod input_section_types.mod negf_subgroup_types.mod qs_energy.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod kinds.mod message_passing.mod qs_energy_init.mod negf_vectors.mod qs_integrate_potential.mod negf_atom_map.mod negf_matrix_utils.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="\"Thu Oct 7 18:02:06 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 'negf_env_types.mod' due to: negf_env_types.o /build/cp2k-Q381vr/cp2k-8.1/src/negf_env_types.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 particle_types.mod pw_pool_types.mod pw_types.mod cell_types.mod qs_subsys_types.mod pw_env_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod force_env_types.mod qs_mo_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod negf_control_types.mod qs_density_mixing_types.mod input_section_types.mod negf_subgroup_types.mod qs_energy.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod kinds.mod message_passing.mod qs_energy_init.mod negf_vectors.mod qs_integrate_potential.mod negf_atom_map.mod negf_matrix_utils.mod true /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 mathconstants.mod cp_cfm_basic_linalg.mod cp_fm_struct.mod kinds.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="\"Thu Oct 7 18:02:13 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:541: update target 'negf_green_methods.mod' due to: negf_green_methods.o /build/cp2k-Q381vr/cp2k-8.1/src/negf_green_methods.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_fm_types.mod base_hooks.mod mathconstants.mod cp_cfm_basic_linalg.mod cp_fm_struct.mod kinds.mod true /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="\"Thu Oct 7 18:02:13 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_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 mathconstants.mod cp_fm_basic_linalg.mod kinds.mod cp_cfm_basic_linalg.mod negf_integr_utils.mod cp_fm_struct.mod util.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="\"Thu Oct 7 18:02:14 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathconstants.mod cp_fm_basic_linalg.mod kinds.mod cp_cfm_basic_linalg.mod negf_integr_utils.mod cp_fm_struct.mod util.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 fft_tools.mod mathconstants.mod kahan_sum.mod cp_fm_basic_linalg.mod kinds.mod cp_cfm_basic_linalg.mod negf_integr_utils.mod cp_fm_struct.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="\"Thu Oct 7 18:02:15 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:541: update target 'negf_integr_cc.mod' due to: negf_integr_cc.o /build/cp2k-Q381vr/cp2k-8.1/src/negf_integr_cc.F /build/cp2k-Q381vr/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_fm_types.mod base_hooks.mod fft_tools.mod mathconstants.mod kahan_sum.mod cp_fm_basic_linalg.mod kinds.mod cp_cfm_basic_linalg.mod negf_integr_utils.mod cp_fm_struct.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 util.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_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="\"Thu Oct 7 18:02:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 util.mod base_hooks.mod kinds.mod 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 cp_cfm_types.mod qs_subsys_types.mod negf_env_types.mod cp_control_types.mod cp_para_types.mod cp_fm_types.mod force_env_types.mod global_types.mod kpoint_types.mod qs_rho_types.mod qs_environment_types.mod cp_subsys_types.mod negf_control_types.mod qs_density_mixing_types.mod input_section_types.mod negf_subgroup_types.mod base_hooks.mod qs_mixing_utils.mod string_utilities.mod negf_green_methods.mod qs_ks_methods.mod cp_blacs_env.mod cp_fm_struct.mod kinds.mod cp_cfm_basic_linalg.mod qs_scf_methods.mod negf_integr_simpson.mod input_constants.mod cp_log_handling.mod message_passing.mod bibliography.mod physcon.mod mathconstants.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_gspace_mixing.mod machine.mod negf_integr_cc.mod negf_green_cache.mod qs_rho_methods.mod negf_matrix_utils.mod cp_dbcsr_operations.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="\"Thu Oct 7 18:02:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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="\"Thu Oct 7 18:02:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:541: update target 'farming_types.mod' due to: farming_types.o /build/cp2k-Q381vr/cp2k-8.1/src/farming_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 '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 farming_types.mod cp_para_types.mod input_section_types.mod base_hooks.mod cp_log_handling.mod message_passing.mod cp_output_handling.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="\"Thu Oct 7 18:02:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 cp_fm_types.mod qs_mo_types.mod base_hooks.mod cp_gemm_interface.mod cp_fm_basic_linalg.mod kinds.mod cp_dbcsr_operations.mod cp_fm_diag.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="\"Thu Oct 7 18:02:26 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 powell.mod kinds.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="\"Thu Oct 7 18:02:27 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 'cg_test.mod' due to: cg_test.o 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 '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 input_val_types.mod basis_set_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod orbital_transformation_matrices.mod cp_log_handling.mod generic_shg_integrals.mod generic_shg_integrals_init.mod constants_operator.mod kinds.mod generic_os_integrals.mod input_cp2k_subsys.mod orbital_pointers.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="\"Thu Oct 7 18:02:29 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_val_types.mod basis_set_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod orbital_transformation_matrices.mod cp_log_handling.mod generic_shg_integrals.mod generic_shg_integrals_init.mod constants_operator.mod kinds.mod generic_os_integrals.mod input_cp2k_subsys.mod orbital_pointers.mod 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_types.mod cell_types.mod realspace_grid_types.mod cp_para_types.mod pw_grid_types.mod cp_fm_types.mod parallel_rng_types.mod global_types.mod input_section_types.mod base_hooks.mod cp_eri_mme_interface.mod cp_blacs_env.mod cp_fm_struct.mod cp_gemm_interface.mod cp_files.mod kinds.mod input_constants.mod cp_log_handling.mod message_passing.mod pw_grids.mod minimax_exp.mod mp2_grids.mod pw_methods.mod fft_tools.mod cg_test.mod cp_fm_basic_linalg.mod cp_output_handling.mod cp_fm_diag.mod machine.mod ai_coulomb_test.mod cp_realspace_grid_init.mod shg_integrals_test.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="\"Thu Oct 7 18:02:32 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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_para_types.mod parallel_rng_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod powell.mod environment.mod kinds.mod cp_parser_methods.mod input_constants.mod cp_log_handling.mod message_passing.mod cp2k_info.mod physcon.mod memory_utilities.mod cp_output_handling.mod machine.mod f77_interface.mod cp_external_control.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="\"Thu Oct 7 18:02:38 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mscfg_types.mod atomic_kind_types.mod molecule_types.mod cell_types.mod almo_scf_types.mod cp_para_types.mod force_env_types.mod global_types.mod qs_environment_types.mod cp_subsys_types.mod particle_list_types.mod qs_energy_types.mod input_section_types.mod qs_mo_types.mod qs_energy.mod base_hooks.mod qs_environment.mod kinds.mod cp_subsys_methods.mod cp_log_handling.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/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="\"Thu Oct 7 18:02:42 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 atom_utils.mod input_constants.mod cp_log_handling.mod atom_fit.mod cp_output_handling.mod kinds.mod atom_output.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="\"Thu Oct 7 18:02:45 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 cp_para_types.mod force_env_types.mod global_types.mod qs_environment_types.mod cp_subsys_types.mod particle_list_types.mod qs_energy_types.mod input_section_types.mod qs_energy.mod base_hooks.mod string_utilities.mod qs_environment.mod kinds.mod cp_subsys_methods.mod cp_log_handling.mod input_constants.mod cp2k_info.mod memory_utilities.mod cp_output_handling.mod cp_external_control.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="\"Thu Oct 7 18:02:46 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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_control_types.mod qs_p_env_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod base_hooks.mod qs_matrix_pools.mod kinds.mod cp_blacs_env.mod cp_fm_struct.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="\"Thu Oct 7 18:02:50 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_control_types.mod qs_p_env_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod qs_environment_types.mod base_hooks.mod qs_matrix_pools.mod kinds.mod cp_blacs_env.mod cp_fm_struct.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_tddfpt_types.mod cp_control_types.mod qs_p_env_types.mod qs_environment_types.mod cp_fm_types.mod qs_mo_types.mod base_hooks.mod cp_log_handling.mod cp_fm_cholesky.mod cp_fm_basic_linalg.mod kinds.mod qs_p_env_methods.mod cp_dbcsr_operations.mod physcon.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="\"Thu Oct 7 18:02:52 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 mathlib.mod atom_utils.mod input_constants.mod atom_xc.mod kinds.mod atom_operators.mod atom_output.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="\"Thu Oct 7 18:02:55 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 'optimize_basis_types.mod' due to: optimize_basis_types.o 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 optimize_basis_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod powell.mod string_utilities.mod input_constants.mod cp_log_handling.mod machine.mod kinds.mod cp_files.mod cp_parser_methods.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="\"Thu Oct 7 18:03:03 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod kinds.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="\"Thu Oct 7 18:03:08 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_output_handling.mod kinds.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="\"Thu Oct 7 18:03:09 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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="\"Thu Oct 7 18:03:09 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 particle_types.mod cell_types.mod qs_kind_types.mod cp_control_types.mod cp_para_types.mod force_env_types.mod virial_types.mod qs_environment_types.mod cp_subsys_types.mod input_section_types.mod cp_result_types.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod force_env_methods.mod cp_output_handling.mod cp_result_methods.mod particle_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="\"Thu Oct 7 18:03:10 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 particle_types.mod basis_set_types.mod atomic_kind_types.mod admm_types.mod qs_kind_types.mod cp_control_types.mod qs_neighbor_list_types.mod cp_fm_pool_types.mod cp_para_types.mod basis_set_container_types.mod cp_fm_types.mod qs_ks_types.mod optimize_basis_types.mod qs_rho_types.mod qs_environment_types.mod scf_control_types.mod input_section_types.mod qs_mo_types.mod base_hooks.mod qs_interactions.mod qs_mo_methods.mod string_utilities.mod qs_ks_methods.mod cp_fm_cholesky.mod cp_blacs_env.mod cp_fm_struct.mod kinds.mod input_constants.mod cp_log_handling.mod qs_energy_init.mod qs_mo_io.mod qs_overlap.mod qs_matrix_pools.mod cp_fm_basic_linalg.mod cp_output_handling.mod qs_rho_methods.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="\"Thu Oct 7 18:03:12 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 'atom_admm_methods.mod' due to: atom_admm_methods.o 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 powell.mod atom_utils.mod input_constants.mod lapack.mod atom_electronic_structure.mod mathconstants.mod orbital_transformation_matrices.mod ai_onecenter.mod physcon.mod qs_grid_atom.mod cp_files.mod kinds.mod atom_operators.mod orbital_pointers.mod periodic_table.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="\"Thu Oct 7 18:03:15 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 powell.mod atom_utils.mod input_constants.mod lapack.mod atom_electronic_structure.mod mathconstants.mod orbital_transformation_matrices.mod ai_onecenter.mod physcon.mod qs_grid_atom.mod cp_files.mod kinds.mod atom_operators.mod orbital_pointers.mod periodic_table.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 input_section_types.mod atom_types.mod base_hooks.mod kinds.mod input_constants.mod atom_xc.mod atom_electronic_structure.mod cp_log_handling.mod atom_operators.mod physcon.mod periodic_table.mod atom_sgp.mod mathconstants.mod atom_admm_methods.mod cp_output_handling.mod atom_grb.mod atom_utils.mod atom_fit.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="\"Thu Oct 7 18:03:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 'qs_tddfpt_utils.mod' due to: qs_tddfpt_utils.o 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 cp_control_types.mod qs_p_env_types.mod cp_fm_pool_types.mod cp_para_types.mod cp_fm_types.mod qs_tddfpt_types.mod qs_environment_types.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod kinds.mod input_constants.mod cp_log_handling.mod physcon.mod qs_matrix_pools.mod cp_fm_basic_linalg.mod qs_p_env_methods.mod cp_fm_diag.mod qs_tddfpt_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_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="\"Thu Oct 7 18:03:32 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 atom_utils.mod input_constants.mod cp_log_handling.mod atom_electronic_structure.mod atom_fit.mod cp_output_handling.mod physcon.mod kinds.mod atom_operators.mod atom_output.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="\"Thu Oct 7 18:03:35 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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="\"Thu Oct 7 18:03:37 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 'optbas_fenv_manipulation.mod' due to: optbas_fenv_manipulation.o true /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: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 cp_para_types.mod cp_fm_types.mod force_env_types.mod qs_ks_types.mod optimize_basis_types.mod qs_environment_types.mod input_section_types.mod base_hooks.mod qs_neighbor_lists.mod powell.mod input_cp2k_read.mod cp_blacs_env.mod kinds.mod optbas_fenv_manipulation.mod optimize_basis_utils.mod cp_log_handling.mod message_passing.mod admm_methods.mod optbas_opt_utils.mod cp_para_env.mod machine.mod f77_interface.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="\"Thu Oct 7 18:03:37 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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_p_env_types.mod qs_ks_types.mod qs_tddfpt_types.mod qs_rho_types.mod qs_environment_types.mod qs_scf_types.mod qs_energy_types.mod input_section_types.mod base_hooks.mod xc_pot_saop.mod qs_ks_methods.mod header.mod input_constants.mod cp_log_handling.mod bibliography.mod cp_output_handling.mod qs_tddfpt_utils.mod qs_tddfpt_eigensolver.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="\"Thu Oct 7 18:03:41 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_output_handling.mod input_cp2k_xc.mod kinds.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="\"Thu Oct 7 18:03:43 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 '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 global_types.mod virial_types.mod force_env_types.mod cell_types.mod cp_para_types.mod input_section_types.mod cp_subsys_types.mod force_env_methods.mod base_hooks.mod cp_log_handling.mod message_passing.mod bibliography.mod cp_external_control.mod kinds.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="\"Thu Oct 7 18:03:45 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 semi_empirical_int_num.mod base_hooks.mod semi_empirical_int_utils.mod semi_empirical_int_arrays.mod kinds.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="\"Thu Oct 7 18:03:47 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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 cell_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_output_handling.mod kinds.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="\"Thu Oct 7 18:03:49 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:541: update target 'atom_energy.mod' due to: atom_energy.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'atom_basis.mod' due to: atom_basis.o true /build/cp2k-Q381vr/cp2k-8.1/Makefile:541: update target 'atom_pseudo.mod' due to: atom_pseudo.o 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 input_constants.mod cp_log_handling.mod atom_energy.mod atom_basis.mod cp_output_handling.mod atom_pseudo.mod kinds.mod header.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="\"Thu Oct 7 18:03:50 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_output_handling.mod bibliography.mod kinds.mod physcon.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="\"Thu Oct 7 18:03:51 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: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: task_list_methods.o core_ae.o qs_fb_trial_fns_types.o mdctrl_types.o hfx_ri.o qs_scf_methods.o negf_methods.o qs_tddfpt2_types.o cp_ddapc_types.o mixed_energy_types.o kpoint_types.o qs_rho0_types.o qs_resp.o qs_commutators.o qs_ot_eigensolver.o qs_update_s_mstruct.o hfx_pw_methods.o qmmm_elpot.o qs_overlap.o qs_loc_types.o qs_o3c_types.o kg_environment.o farming_methods.o negf_green_methods.o preconditioner_types.o constraint_4x6.o qs_scf_types.o splines_types.o qs_fb_com_tasks_types.o optbas_opt_utils.o lri_environment_init.o qmmm_se_energy.o mao_wfn_analysis.o cp_external_control.o constraint_fxd.o qs_energy.o qs_tddfpt2_subgroups.o fist_neighbor_list_control.o csvr_system_types.o nnp_model.o replica_methods.o group_dist_types.o qmmmx_util.o hfx_pair_list_methods.o input_cp2k_global.o qs_scf_post_gpw.o pao_methods.o dm_ls_scf_create.o al_system_types.o qs_tddfpt2_stda_utils.o input_cp2k_embed.o se_fock_matrix_exchange.o ec_efield_local.o mp2.o rpa_main.o rt_propagation_forces.o qs_mo_occupation.o rpa_gw.o pexsi_types.o graphcon.o cp_dbcsr_output.o auto_basis.o qs_ks_apply_restraints.o qs_ot.o sirius_interface.o cp_realspace_grid_init.o qs_loc_utils.o semi_empirical_integrals.o optimize_basis_types.o qs_diis_types.o library_tests.o qs_scf_csr_write.o cp_subsys_methods.o atom_kind_orbitals.o molecular_states.o f77_interface.o force_fields_util.o qs_block_davidson_types.o uff_vdw_radii_table.o optimize_input.o qs_ot_types.o se_core_matrix.o qs_environment.o input_cp2k_qmmm.o rpa_gw_im_time_util.o qs_interactions.o mp2_optimize_ri_basis.o dft_plus_u.o rpa_rse.o mscfg_methods.o force_env_methods.o csvr_system_utils.o fist_main.o qs_dispersion_types.o input_cp2k_check.o qmmm_force.o lri_environment_types.o qs_density_mixing_types.o fist_efield_types.o qs_linres_epr_ownutils.o linesearch.o mp2_eri_gpw.o qmmm_topology_util.o pexsi_interface.o xc_adiabatic_methods.o pao_param_gth.o atom_xc.o topology_xyz.o input_cp2k_distribution.o qs_elf_methods.o qs_kpp1_env_methods.o qs_rho_atom_methods.o libint_2c_3c.o qs_moments.o mp2_ri_grad.o negf_control_types.o paw_proj_set_types.o global_types.o transport_env_types.o ct_methods.o dm_ls_scf_methods.o embed_main.o atom_basis.o wannier_states_types.o almo_scf_lbfgs_types.o qs_cdft_scf_utils.o qs_harmonics_atom.o rmsd.o qs_chargemol.o mp2_laplace.o ec_env_types.o qs_fb_hash_table_types.o nnp_environment_types.o nnp_acsf.o cp_dbcsr_cp2k_link.o xas_methods.o pair_potential_coulomb.o qs_active_space_methods.o qs_gcp_utils.o qs_fb_matrix_data_types.o qmmm_gaussian_input.o kpoint_methods.o ewalds.o et_coupling_types.o cp2k_info.o qs_kpp1_env_types.o qs_subsys_types.o constraint_3x3.o mixed_environment.o qs_external_density.o submatrix_types.o rpa_gw_kpoints.o pao_ml.o almo_scf.o negf_green_cache.o manybody_gal.o et_coupling.o topology_amber.o molecular_moments.o input_cp2k_ls.o block_p_types.o atom_sgp.o minbas_methods.o input_cp2k_loc.o qs_scf_initialization.o pwdft_environment_types.o ewald_environment_types.o qs_linres_current_utils.o atom_utils.o force_fields_input.o qs_wf_history_methods.o lri_environment_methods.o qs_o3c_methods.o fist_environment_types.o qs_ks_qmmm_types.o mp2_ri_gpw.o qs_linres_types.o kg_correction.o atomic_charges.o lri_integrals.o xas_tdp_integrals.o qmmm_pw_grid.o semi_empirical_mpole_types.o cp_dbcsr_cholesky.o qs_epr_hyp.o submatrix_dissection.o rpa_axk.o qs_matrix_pools.o qs_kind_types.o minbas_wfn_analysis.o cp_ddapc_forces.o domain_submatrix_types.o input_cp2k_eip.o localization_tb.o qs_wannier90.o lri_forces.o xtb_parameters.o topology_pdb.o cp_ddapc_methods.o input_cp2k_motion_print.o cp_dbcsr_diag.o qs_tddfpt2_fhxc.o hfx_screening_methods.o qs_localization_methods.o topology_gromos.o topology_cp2k.o splines_methods.o admm_types.o qs_charge_mixing.o dm_ls_scf.o population_analyses.o qs_dftb_types.o gle_system_types.o kpoint_transitional.o qs_core_hamiltonian.o constraint.o transport.o distribution_methods.o input_cp2k_subsys.o qs_integrate_potential_single.o input_cp2k_binary_restarts.o bsse.o rel_control_types.o qs_scf.o qs_scf_post_tb.o fist_nonbond_force.o almo_scf_methods.o qs_dftb3_methods.o hfx_energy_potential.o semi_empirical_utils.o force_field_types.o qmmmx_force.o manybody_tersoff.o manybody_quip.o negf_integr_utils.o qs_ot_scf.o fist_force.o matrix_exp.o mixed_environment_types.o xtb_ehess.o statistical_methods.o qs_dftb_coulomb.o ri_environment_methods.o topology_util.o topology_input.o qs_environment_methods.o input_cp2k_kpoints.o nnp_environment.o qmmm_gaussian_types.o free_energy_types.o atom_types.o input_cp2k_dft.o qs_energy_init.o qs_rho0_methods.o rpa_communication.o qs_linres_nmr_utils.o qs_ot_minimizer.o qs_tddfpt_utils.o atom_admm_methods.o response_solver.o almo_scf_env_methods.o cp_ddapc.o cp_gemm_interface.o fist_pol_scf.o dm_ls_chebyshev.o qs_linres_methods.o input_cp2k_restarts_util.o semi_empirical_int_gks.o optimize_basis_utils.o mp2_gpw_method.o xtb_types.o qs_dispersion_utils.o header.o input_optimize_basis.o mol_force.o rpa_im_time.o input_optimize_input.o iterate_matrix.o qs_oce_types.o qs_cdft_opt_types.o se_fock_matrix_integrals.o qmmmx_update.o preconditioner_apply.o surface_dipole.o mp2_gpw.o sap_kind_types.o mao_types.o pao_ml_neuralnet.o pair_potential_types.o efield_tb_methods.o preconditioner.o force_env_utils.o qs_ks_atom.o qs_electric_field_gradient.o qs_pdos.o cp2k_debug.o optbas_fenv_manipulation.o atom_energy.o topology_generate_util.o qs_core_energies.o commutator_rpnl.o constraint_util.o qs_sccs.o xc_write_output.o negf_vectors.o qs_integral_utils.o negf_subgroup_types.o hfx_derivatives.o atom_upf.o hirshfeld_types.o lri_optimize_ri_basis_types.o external_potential_methods.o mp2_ri_grad_util.o qs_neighbor_lists.o colvar_methods.o qmmm_image_charge.o xas_tdp_types.o dkh_main.o et_coupling_proj.o wannier_states.o qs_active_space_types.o qs_tddfpt2_operators.o negf_env_types.o pao_linpot_rotinv.o input_cp2k_colvar.o atom_operators.o atoms_input.o input_cp2k_almo.o pao_main.o xc_pot_saop.o qs_ks_qmmm_methods.o qs_rho_methods.o qs_energy_window.o rpa_gw_ic.o qmmm_create.o qs_tensors_types.o qmmm_links_methods.o force_env_types.o semi_empirical_expns3_types.o qmmm_gaussian_data.o qs_tddfpt_eigensolver.o qmmm_types.o pao_param.o basis_set_output.o lri_ks_methods.o motion_utils.o cp_control_utils.o semi_empirical_int3_utils.o qs_wf_history_types.o qs_cdft_types.o qs_fb_input.o qs_scf_post_scf.o qs_fb_distribution_methods.o qmmm_se_forces.o qs_dos.o atom_fit.o atom_pseudo.o qmmm_gpw_forces.o qs_external_potential.o atom_grb.o qs_initial_guess.o pilaenv_hack.o molsym.o optimize_basis.o qs_tddfpt2_methods.o dm_ls_scf_qs.o metadynamics_utils.o qs_scf_loop_utils.o fist_nonbond_env_types.o semi_empirical_int_ana.o eip_silicon.o qs_gcp_method.o input_cp2k_mixed.o exclusion_types.o xas_tdp_correction.o mp2_integrals.o qs_elec_field.o xtb_coulomb.o task_list_types.o efield_utils.o qs_environment_types.o qs_tddfpt_types.o fp_types.o input_cp2k_rsgrid.o almo_scf_qs.o pme_tools.o qs_rho_atom_types.o mp2_grids.o pw_env_methods.o mulliken.o libint_wrapper.o qs_p_env_types.o mp2_cphf.o qmmm_tb_coulomb.o cp_realspace_grid_cube.o semi_empirical_int_num.o hartree_local_methods.o ewald_pw_types.o input_cp2k_neb.o fp_methods.o se_fock_matrix.o ct_types.o negf_atom_map.o simpar_types.o input_cp2k_tb.o mode_selective.o cp_dbcsr_operations.o qs_integrate_potential_product.o semi_empirical_types.o mp2_ri_2c.o topology_constraint_util.o qs_period_efield_types.o molden_utils.o se_core_core.o s_square_methods.o cp_eri_mme_interface.o qs_tddfpt2_eigensolver.o qs_nl_hash_table_types.o qs_dispersion_pairpot.o stm_images.o integration_grid_types.o qmmm_init.o qs_scf_lanczos.o dm_ls_scf_curvy.o subcell_types.o kpoint_coulomb_2c.o hfx_load_balance_methods.o beta_gamma_psi.o lri_compression.o qs_fb_env_methods.o pw_poisson_read_input.o xas_control.o almo_scf_types.o topology_connectivity_util.o voronoi_interface.o hfx_communication.o wannier90.o qs_vxc.o pao_linpot_full.o hfx_libint_interface.o qs_tddfpt_module.o qs_linres_current.o commutator_rkinetic.o input_cp2k_transport.o hfx_admm_utils.o negf_integr_cc.o qs_tddfpt2_utils.o hfx_compression_methods.o optimize_embedding_potential.o manybody_siepmann.o mixed_cdft_utils.o qs_linres_issc_utils.o qs_fb_buffer_types.o constraint_vsite.o qs_collocate_density.o input_restart_force_eval.o mixed_environment_utils.o qs_ks_utils.o domain_submatrix_methods.o input_cp2k_atom.o qs_loc_states.o input_cp2k_ec.o qs_linres_epr_utils.o input_cp2k_atprop.o preconditioner_solvers.o mp2_types.o pao_param_exp.o negf_alloc_types.o pme.o input_cp2k_mp2.o rt_propagation_types.o scine_utils.o xas_restart.o pao_ml_gaussprocess.o pao_optimizer.o input_cp2k_poisson.o spme.o input_cp2k_mm.o core_ppl.o admm_dm_types.o qs_linres_epr_nablavks.o qs_fermi_contact.o input_cp2k_properties_dft.o input_cp2k_thermostats.o qmmm_per_elpot.o qs_vxc_atom.o qs_tddfpt2_densities.o energy_corrections.o qs_cdft_methods.o force_fields.o input_constants.o core_ppnl.o qs_gamma2kp.o hirshfeld_methods.o ipi_driver.o mp2_direct_method.o xas_tdp_utils.o hartree_local_types.o mscfg_types.o qs_linres_op.o force_fields_all.o input_cp2k_nnp.o qs_mo_io.o kg_environment_types.o qs_dftb_utils.o xas_tp_scf.o qs_ks_methods.o hfx_helpers.o mao_basis.o qs_mom_types.o qs_efield_berry.o qs_scf_diagonalization.o qmmmx_types.o debug_os_integrals.o pao_io.o admm_dm_methods.o kg_tnadd_mat.o pair_potential.o semi_empirical_int_debug.o topology_psf.o kg_vertex_coloring_methods.o topology_cif.o qs_scf_output.o qs_linres_nmr_epr_common_utils.o cell_methods.o ewald_spline_util.o input_cp2k_constraints.o extended_system_types.o qs_condnum.o qs_outer_scf.o input_cp2k_resp.o qs_loc_dipole.o rtp_admm_methods.o atom_output.o xas_tdp_atom.o mm_mapping_library.o xc_adiabatic_utils.o qs_efield_local.o scf_control_types.o input_cp2k_field.o qs_diis.o qs_dispersion_nonloc.o qs_rho_types.o qs_gapw_densities.o embed_types.o pao_potentials.o rpa_util.o qs_local_rho_types.o qs_mo_types.o qs_integrate_potential.o pao_param_fock.o qs_oce_methods.o lri_optimize_ri_basis.o qs_mo_methods.o molecular_dipoles.o cp_symmetry.o qs_scf_post_se.o pao_ml_descriptor.o input_cp2k_external.o semi_empirical_expns3_methods.o qs_energy_matrix_w.o qs_fb_filter_matrix_methods.o qs_band_structure.o manybody_potential.o mp2_eri.o cp_control_types.o force_fields_ext.o qs_linres_polar_utils.o embed_environment.o pair_potential_util.o restraint.o farming_types.o qs_scf_wfn_mix.o environment.o taper_types.o mm_collocate_potential.o fist_neighbor_list_types.o mixed_cdft_types.o atom_electronic_structure.o ewald_methods_tb.o pao_types.o qs_linres_nmr_shift.o preconditioner_makes.o outer_scf_control_types.o shg_integrals_test.o colvar_utils.o se_fock_matrix_coulomb.o qs_dftb_matrices.o qs_dftb_parameters.o negf_integr_simpson.o mp2_setup.o almo_scf_optimizer.o topology_coordinate_util.o qmmm_types_low.o mao_optimizer.o qs_ks_types.o qs_rho0_ggrid.o qs_mom_methods.o qs_kinetic.o qmmm_gaussian_init.o grrm_utils.o virial_methods.o admm_utils.o ewald_pw_methods.o dm_ls_scf_types.o ewalds_multipole.o qs_force_types.o fist_energy_types.o qs_tensors.o input_cp2k_read.o fist_environment.o qs_hash_table_functions.o qs_gspace_mixing.o particle_methods.o input_cp2k_force_eval.o qs_operators_ao.o qs_charges_types.o eip_environment.o pwdft_environment.o fist_efield_methods.o qs_basis_gradient.o mixed_main.o nnp_force.o replica_types.o admm_methods.o xray_diffraction.o qmmmx_create.o cryssym.o qs_dftb_dispersion.o pexsi_methods.o qs_fb_atomic_matrix_methods.o qs_linres_atom_current.o moments_utils.o atom.o pao_param_linpot.o qs_neighbor_list_types.o semi_empirical_int_utils.o se_fock_matrix_dbg.o fermi_utils.o qmmm_ff_fist.o input_cp2k_hfx.o semi_empirical_parameters.o input_cp2k_free_energy.o fist_neighbor_lists.o semi_empirical_par_utils.o metadynamics.o input_restart_rng.o qs_subsys_methods.o ec_environment.o rpa_kpoints.o generic_os_integrals.o cp_ddapc_util.o qs_mixing_utils.o qs_local_properties.o qs_fb_atomic_halo_types.o qs_grid_atom.o xtb_matrices.o metadynamics_types.o qs_scf_block_davidson.o manybody_eam.o negf_matrix_utils.o qs_tddfpt2_restart.o atom_optimization.o qs_tddfpt2_properties.o qmmm_gpw_energy.o topology.o qs_cdft_utils.o optimize_dmfet_potential.o qs_tddfpt2_stda_types.o semi_empirical_store_int_types.o kpoint_io.o maxwell_solver_interface.o topology_types.o pao_input.o xas_tdp_methods.o ls_matrix_exp.o topology_multiple_unit_cell.o input_cp2k_negf.o qs_gcp_types.o qmmm_util.o semi_empirical_mpole_methods.o eip_environment_types.o qs_spin_orbit.o qs_fb_env_types.o mao_methods.o distribution_2d_types.o qs_force.o semi_empirical_int_arrays.o mixed_cdft_methods.o bse.o xas_tdp_kernel.o qs_energy_utils.o qs_linres_module.o input_cp2k_xc.o constraint_clv.o fist_intra_force.o spglib_f08.o qmmm_tb_methods.o qs_energy_types.o qs_loc_methods.o qs_loc_molecules.o topology_xtl.o qs_p_env_methods.o hfx_types.o xas_env_types.o almo_scf_diis_types.o mp2_ri_libint.o input_cp2k_pwdft.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 task_list_methods.o core_ae.o qs_fb_trial_fns_types.o mdctrl_types.o hfx_ri.o qs_scf_methods.o negf_methods.o qs_tddfpt2_types.o cp_ddapc_types.o mixed_energy_types.o kpoint_types.o qs_rho0_types.o qs_resp.o qs_commutators.o qs_ot_eigensolver.o qs_update_s_mstruct.o hfx_pw_methods.o qmmm_elpot.o qs_overlap.o qs_loc_types.o qs_o3c_types.o kg_environment.o farming_methods.o negf_green_methods.o preconditioner_types.o constraint_4x6.o qs_scf_types.o splines_types.o qs_fb_com_tasks_types.o optbas_opt_utils.o lri_environment_init.o qmmm_se_energy.o mao_wfn_analysis.o cp_external_control.o constraint_fxd.o qs_energy.o qs_tddfpt2_subgroups.o fist_neighbor_list_control.o csvr_system_types.o nnp_model.o replica_methods.o group_dist_types.o qmmmx_util.o hfx_pair_list_methods.o input_cp2k_global.o qs_scf_post_gpw.o pao_methods.o dm_ls_scf_create.o al_system_types.o qs_tddfpt2_stda_utils.o input_cp2k_embed.o se_fock_matrix_exchange.o ec_efield_local.o mp2.o rpa_main.o rt_propagation_forces.o qs_mo_occupation.o rpa_gw.o pexsi_types.o graphcon.o cp_dbcsr_output.o auto_basis.o qs_ks_apply_restraints.o qs_ot.o sirius_interface.o cp_realspace_grid_init.o qs_loc_utils.o semi_empirical_integrals.o optimize_basis_types.o qs_diis_types.o library_tests.o qs_scf_csr_write.o cp_subsys_methods.o atom_kind_orbitals.o molecular_states.o f77_interface.o force_fields_util.o qs_block_davidson_types.o uff_vdw_radii_table.o optimize_input.o qs_ot_types.o se_core_matrix.o qs_environment.o input_cp2k_qmmm.o rpa_gw_im_time_util.o qs_interactions.o mp2_optimize_ri_basis.o dft_plus_u.o rpa_rse.o mscfg_methods.o force_env_methods.o csvr_system_utils.o fist_main.o qs_dispersion_types.o input_cp2k_check.o qmmm_force.o lri_environment_types.o qs_density_mixing_types.o fist_efield_types.o qs_linres_epr_ownutils.o linesearch.o mp2_eri_gpw.o qmmm_topology_util.o pexsi_interface.o xc_adiabatic_methods.o pao_param_gth.o atom_xc.o topology_xyz.o input_cp2k_distribution.o qs_elf_methods.o qs_kpp1_env_methods.o qs_rho_atom_methods.o libint_2c_3c.o qs_moments.o mp2_ri_grad.o negf_control_types.o paw_proj_set_types.o global_types.o transport_env_types.o ct_methods.o dm_ls_scf_methods.o embed_main.o atom_basis.o wannier_states_types.o almo_scf_lbfgs_types.o qs_cdft_scf_utils.o qs_harmonics_atom.o rmsd.o qs_chargemol.o mp2_laplace.o ec_env_types.o qs_fb_hash_table_types.o nnp_environment_types.o nnp_acsf.o cp_dbcsr_cp2k_link.o xas_methods.o pair_potential_coulomb.o qs_active_space_methods.o qs_gcp_utils.o qs_fb_matrix_data_types.o qmmm_gaussian_input.o kpoint_methods.o ewalds.o et_coupling_types.o cp2k_info.o qs_kpp1_env_types.o qs_subsys_types.o constraint_3x3.o mixed_environment.o qs_external_density.o submatrix_types.o rpa_gw_kpoints.o pao_ml.o almo_scf.o negf_green_cache.o manybody_gal.o et_coupling.o topology_amber.o molecular_moments.o input_cp2k_ls.o block_p_types.o atom_sgp.o minbas_methods.o input_cp2k_loc.o qs_scf_initialization.o pwdft_environment_types.o ewald_environment_types.o qs_linres_current_utils.o atom_utils.o force_fields_input.o qs_wf_history_methods.o lri_environment_methods.o qs_o3c_methods.o fist_environment_types.o qs_ks_qmmm_types.o mp2_ri_gpw.o qs_linres_types.o kg_correction.o atomic_charges.o lri_integrals.o xas_tdp_integrals.o qmmm_pw_grid.o semi_empirical_mpole_types.o cp_dbcsr_cholesky.o qs_epr_hyp.o submatrix_dissection.o rpa_axk.o qs_matrix_pools.o qs_kind_types.o minbas_wfn_analysis.o cp_ddapc_forces.o domain_submatrix_types.o input_cp2k_eip.o localization_tb.o qs_wannier90.o lri_forces.o xtb_parameters.o topology_pdb.o cp_ddapc_methods.o input_cp2k_motion_print.o cp_dbcsr_diag.o qs_tddfpt2_fhxc.o hfx_screening_methods.o qs_localization_methods.o topology_gromos.o topology_cp2k.o splines_methods.o admm_types.o qs_charge_mixing.o dm_ls_scf.o population_analyses.o qs_dftb_types.o gle_system_types.o kpoint_transitional.o qs_core_hamiltonian.o constraint.o transport.o distribution_methods.o input_cp2k_subsys.o qs_integrate_potential_single.o input_cp2k_binary_restarts.o bsse.o rel_control_types.o qs_scf.o qs_scf_post_tb.o fist_nonbond_force.o almo_scf_methods.o qs_dftb3_methods.o hfx_energy_potential.o semi_empirical_utils.o force_field_types.o qmmmx_force.o manybody_tersoff.o manybody_quip.o negf_integr_utils.o qs_ot_scf.o fist_force.o matrix_exp.o mixed_environment_types.o xtb_ehess.o statistical_methods.o qs_dftb_coulomb.o ri_environment_methods.o topology_util.o topology_input.o qs_environment_methods.o input_cp2k_kpoints.o nnp_environment.o qmmm_gaussian_types.o free_energy_types.o atom_types.o input_cp2k_dft.o qs_energy_init.o qs_rho0_methods.o rpa_communication.o qs_linres_nmr_utils.o qs_ot_minimizer.o qs_tddfpt_utils.o atom_admm_methods.o response_solver.o almo_scf_env_methods.o cp_ddapc.o cp_gemm_interface.o fist_pol_scf.o dm_ls_chebyshev.o qs_linres_methods.o input_cp2k_restarts_util.o semi_empirical_int_gks.o optimize_basis_utils.o mp2_gpw_method.o xtb_types.o qs_dispersion_utils.o header.o input_optimize_basis.o mol_force.o rpa_im_time.o input_optimize_input.o iterate_matrix.o qs_oce_types.o qs_cdft_opt_types.o se_fock_matrix_integrals.o qmmmx_update.o preconditioner_apply.o surface_dipole.o mp2_gpw.o sap_kind_types.o mao_types.o pao_ml_neuralnet.o pair_potential_types.o efield_tb_methods.o preconditioner.o force_env_utils.o qs_ks_atom.o qs_electric_field_gradient.o qs_pdos.o cp2k_debug.o optbas_fenv_manipulation.o atom_energy.o topology_generate_util.o qs_core_energies.o commutator_rpnl.o constraint_util.o qs_sccs.o xc_write_output.o negf_vectors.o qs_integral_utils.o negf_subgroup_types.o hfx_derivatives.o atom_upf.o hirshfeld_types.o lri_optimize_ri_basis_types.o external_potential_methods.o mp2_ri_grad_util.o qs_neighbor_lists.o colvar_methods.o qmmm_image_charge.o xas_tdp_types.o dkh_main.o et_coupling_proj.o wannier_states.o qs_active_space_types.o qs_tddfpt2_operators.o negf_env_types.o pao_linpot_rotinv.o input_cp2k_colvar.o atom_operators.o atoms_input.o input_cp2k_almo.o pao_main.o xc_pot_saop.o qs_ks_qmmm_methods.o qs_rho_methods.o qs_energy_window.o rpa_gw_ic.o qmmm_create.o qs_tensors_types.o qmmm_links_methods.o force_env_types.o semi_empirical_expns3_types.o qmmm_gaussian_data.o qs_tddfpt_eigensolver.o qmmm_types.o pao_param.o basis_set_output.o lri_ks_methods.o motion_utils.o cp_control_utils.o semi_empirical_int3_utils.o qs_wf_history_types.o qs_cdft_types.o qs_fb_input.o qs_scf_post_scf.o qs_fb_distribution_methods.o qmmm_se_forces.o qs_dos.o atom_fit.o atom_pseudo.o qmmm_gpw_forces.o qs_external_potential.o atom_grb.o qs_initial_guess.o pilaenv_hack.o molsym.o optimize_basis.o qs_tddfpt2_methods.o dm_ls_scf_qs.o metadynamics_utils.o qs_scf_loop_utils.o fist_nonbond_env_types.o semi_empirical_int_ana.o eip_silicon.o qs_gcp_method.o input_cp2k_mixed.o exclusion_types.o xas_tdp_correction.o mp2_integrals.o qs_elec_field.o xtb_coulomb.o task_list_types.o efield_utils.o qs_environment_types.o qs_tddfpt_types.o fp_types.o input_cp2k_rsgrid.o almo_scf_qs.o pme_tools.o qs_rho_atom_types.o mp2_grids.o pw_env_methods.o mulliken.o libint_wrapper.o qs_p_env_types.o mp2_cphf.o qmmm_tb_coulomb.o cp_realspace_grid_cube.o semi_empirical_int_num.o hartree_local_methods.o ewald_pw_types.o input_cp2k_neb.o fp_methods.o se_fock_matrix.o ct_types.o negf_atom_map.o simpar_types.o input_cp2k_tb.o mode_selective.o cp_dbcsr_operations.o qs_integrate_potential_product.o semi_empirical_types.o mp2_ri_2c.o topology_constraint_util.o qs_period_efield_types.o molden_utils.o se_core_core.o s_square_methods.o cp_eri_mme_interface.o qs_tddfpt2_eigensolver.o qs_nl_hash_table_types.o qs_dispersion_pairpot.o stm_images.o integration_grid_types.o qmmm_init.o qs_scf_lanczos.o dm_ls_scf_curvy.o subcell_types.o kpoint_coulomb_2c.o hfx_load_balance_methods.o beta_gamma_psi.o lri_compression.o qs_fb_env_methods.o pw_poisson_read_input.o xas_control.o almo_scf_types.o topology_connectivity_util.o voronoi_interface.o hfx_communication.o wannier90.o qs_vxc.o pao_linpot_full.o hfx_libint_interface.o qs_tddfpt_module.o qs_linres_current.o commutator_rkinetic.o input_cp2k_transport.o hfx_admm_utils.o negf_integr_cc.o qs_tddfpt2_utils.o hfx_compression_methods.o optimize_embedding_potential.o manybody_siepmann.o mixed_cdft_utils.o qs_linres_issc_utils.o qs_fb_buffer_types.o constraint_vsite.o qs_collocate_density.o input_restart_force_eval.o mixed_environment_utils.o qs_ks_utils.o domain_submatrix_methods.o input_cp2k_atom.o qs_loc_states.o input_cp2k_ec.o qs_linres_epr_utils.o input_cp2k_atprop.o preconditioner_solvers.o mp2_types.o pao_param_exp.o negf_alloc_types.o pme.o input_cp2k_mp2.o rt_propagation_types.o scine_utils.o xas_restart.o pao_ml_gaussprocess.o pao_optimizer.o input_cp2k_poisson.o spme.o input_cp2k_mm.o core_ppl.o admm_dm_types.o qs_linres_epr_nablavks.o qs_fermi_contact.o input_cp2k_properties_dft.o input_cp2k_thermostats.o qmmm_per_elpot.o qs_vxc_atom.o qs_tddfpt2_densities.o energy_corrections.o qs_cdft_methods.o force_fields.o input_constants.o core_ppnl.o qs_gamma2kp.o hirshfeld_methods.o ipi_driver.o mp2_direct_method.o xas_tdp_utils.o hartree_local_types.o mscfg_types.o qs_linres_op.o force_fields_all.o input_cp2k_nnp.o qs_mo_io.o kg_environment_types.o qs_dftb_utils.o xas_tp_scf.o qs_ks_methods.o hfx_helpers.o mao_basis.o qs_mom_types.o qs_efield_berry.o qs_scf_diagonalization.o qmmmx_types.o debug_os_integrals.o pao_io.o admm_dm_methods.o kg_tnadd_mat.o pair_potential.o semi_empirical_int_debug.o topology_psf.o kg_vertex_coloring_methods.o topology_cif.o qs_scf_output.o qs_linres_nmr_epr_common_utils.o cell_methods.o ewald_spline_util.o input_cp2k_constraints.o extended_system_types.o qs_condnum.o qs_outer_scf.o input_cp2k_resp.o qs_loc_dipole.o rtp_admm_methods.o atom_output.o xas_tdp_atom.o mm_mapping_library.o xc_adiabatic_utils.o qs_efield_local.o scf_control_types.o input_cp2k_field.o qs_diis.o qs_dispersion_nonloc.o qs_rho_types.o qs_gapw_densities.o embed_types.o pao_potentials.o rpa_util.o qs_local_rho_types.o qs_mo_types.o qs_integrate_potential.o pao_param_fock.o qs_oce_methods.o lri_optimize_ri_basis.o qs_mo_methods.o molecular_dipoles.o cp_symmetry.o qs_scf_post_se.o pao_ml_descriptor.o input_cp2k_external.o semi_empirical_expns3_methods.o qs_energy_matrix_w.o qs_fb_filter_matrix_methods.o qs_band_structure.o manybody_potential.o mp2_eri.o cp_control_types.o force_fields_ext.o qs_linres_polar_utils.o embed_environment.o pair_potential_util.o restraint.o farming_types.o qs_scf_wfn_mix.o environment.o taper_types.o mm_collocate_potential.o fist_neighbor_list_types.o mixed_cdft_types.o atom_electronic_structure.o ewald_methods_tb.o pao_types.o qs_linres_nmr_shift.o preconditioner_makes.o outer_scf_control_types.o shg_integrals_test.o colvar_utils.o se_fock_matrix_coulomb.o qs_dftb_matrices.o qs_dftb_parameters.o negf_integr_simpson.o mp2_setup.o almo_scf_optimizer.o topology_coordinate_util.o qmmm_types_low.o mao_optimizer.o qs_ks_types.o qs_rho0_ggrid.o qs_mom_methods.o qs_kinetic.o qmmm_gaussian_init.o grrm_utils.o virial_methods.o admm_utils.o ewald_pw_methods.o dm_ls_scf_types.o ewalds_multipole.o qs_force_types.o fist_energy_types.o qs_tensors.o input_cp2k_read.o fist_environment.o qs_hash_table_functions.o qs_gspace_mixing.o particle_methods.o input_cp2k_force_eval.o qs_operators_ao.o qs_charges_types.o eip_environment.o pwdft_environment.o fist_efield_methods.o qs_basis_gradient.o mixed_main.o nnp_force.o replica_types.o admm_methods.o xray_diffraction.o qmmmx_create.o cryssym.o qs_dftb_dispersion.o pexsi_methods.o qs_fb_atomic_matrix_methods.o qs_linres_atom_current.o moments_utils.o atom.o pao_param_linpot.o qs_neighbor_list_types.o semi_empirical_int_utils.o se_fock_matrix_dbg.o fermi_utils.o qmmm_ff_fist.o input_cp2k_hfx.o semi_empirical_parameters.o input_cp2k_free_energy.o fist_neighbor_lists.o semi_empirical_par_utils.o metadynamics.o input_restart_rng.o qs_subsys_methods.o ec_environment.o rpa_kpoints.o generic_os_integrals.o cp_ddapc_util.o qs_mixing_utils.o qs_local_properties.o qs_fb_atomic_halo_types.o qs_grid_atom.o xtb_matrices.o metadynamics_types.o qs_scf_block_davidson.o manybody_eam.o negf_matrix_utils.o qs_tddfpt2_restart.o atom_optimization.o qs_tddfpt2_properties.o qmmm_gpw_energy.o topology.o qs_cdft_utils.o optimize_dmfet_potential.o qs_tddfpt2_stda_types.o semi_empirical_store_int_types.o kpoint_io.o maxwell_solver_interface.o topology_types.o pao_input.o xas_tdp_methods.o ls_matrix_exp.o topology_multiple_unit_cell.o input_cp2k_negf.o qs_gcp_types.o qmmm_util.o semi_empirical_mpole_methods.o eip_environment_types.o qs_spin_orbit.o qs_fb_env_types.o mao_methods.o distribution_2d_types.o qs_force.o semi_empirical_int_arrays.o mixed_cdft_methods.o bse.o xas_tdp_kernel.o qs_energy_utils.o qs_linres_module.o input_cp2k_xc.o constraint_clv.o fist_intra_force.o spglib_f08.o qmmm_tb_methods.o qs_energy_types.o qs_loc_methods.o qs_loc_molecules.o topology_xtl.o qs_p_env_methods.o hfx_types.o xas_env_types.o almo_scf_diis_types.o mp2_ri_libint.o input_cp2k_pwdft.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_geev.o arnoldi_types.o arnoldi_methods.o arnoldi_api.o arnoldi_data_methods.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_geev.o arnoldi_types.o arnoldi_methods.o arnoldi_api.o arnoldi_data_methods.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.o s_contract_shg.o generic_shg_integrals_init.o constants_operator.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.o s_contract_shg.o generic_shg_integrals_init.o constants_operator.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_types.o eri_mme_gaussian.o eri_mme_lattice_summation.o eri_mme_test.o eri_mme_integrate.o eri_mme_util.o eri_mme_error_control.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_types.o eri_mme_gaussian.o eri_mme_lattice_summation.o eri_mme_test.o eri_mme_integrate.o eri_mme_util.o eri_mme_error_control.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_gw.o minimax_exp_k53.o minimax_rpa.o minimax_exp.o minimax_exp_k15.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_gw.o minimax_exp_k53.o minimax_rpa.o minimax_exp.o minimax_exp_k15.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_compression_core_methods.o hfx_contraction_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_compression_core_methods.o hfx_contraction_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_tpss.o xc_lyp_adiabatic.o xc_xbecke88.o xc_pbe.o xc_optx.o cp_linked_list_xc_deriv.o xc_libxc_wrap.o xc_sr_lda.o xc_xlda_hole_t_c_lr.o xc_xbeef.o xc_ke_gga.o xc_thomas_fermi.o xc_functionals_utilities.o xc_libxc.o xc_pade.o xc_xbecke88_lr_adiabatic.o xc_tfw.o xc_xalpha.o xc_rho_cflags_types.o xc_derivative_set_types.o xc_derivative_types.o xc.o xc_xwpbe.o xc_xbecke88_long_range.o xc_vwn.o xc_b97.o xc_hcth.o xc_cs1.o xc_xbr_pbe_lda_hole_t_c_lr.o xc_rho_set_types.o xc_xbecke_roussel.o xc_exchange_gga.o xc_perdew86.o xc_lyp.o xc_perdew_wang.o xc_atom.o xc_derivatives.o xc_xpbe_hole_t_c_lr.o xc_perdew_zunger.o xc_derivative_desc.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_tpss.o xc_lyp_adiabatic.o xc_xbecke88.o xc_pbe.o xc_optx.o cp_linked_list_xc_deriv.o xc_libxc_wrap.o xc_sr_lda.o xc_xlda_hole_t_c_lr.o xc_xbeef.o xc_ke_gga.o xc_thomas_fermi.o xc_functionals_utilities.o xc_libxc.o xc_pade.o xc_xbecke88_lr_adiabatic.o xc_tfw.o xc_xalpha.o xc_rho_cflags_types.o xc_derivative_set_types.o xc_derivative_types.o xc.o xc_xwpbe.o xc_xbecke88_long_range.o xc_vwn.o xc_b97.o xc_hcth.o xc_cs1.o xc_xbr_pbe_lda_hole_t_c_lr.o xc_rho_set_types.o xc_xbecke_roussel.o xc_exchange_gga.o xc_perdew86.o xc_lyp.o xc_perdew_wang.o xc_atom.o xc_derivatives.o xc_xpbe_hole_t_c_lr.o xc_perdew_zunger.o xc_derivative_desc.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: gaussian_gridlevels.o cp_spline_utils.o pw_env_types.o rs_pw_interface.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 gaussian_gridlevels.o cp_spline_utils.o pw_env_types.o rs_pw_interface.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:119: 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="\"Thu Oct 7 18:03:56 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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="\"Thu Oct 7 18:03:57 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:123: 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="\"Thu Oct 7 18:03:59 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_vib.mod' due to: input_cp2k_vib.o 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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_output_handling.mod bibliography.mod kinds.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="\"Thu Oct 7 18:03:59 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod cp_output_handling.mod bibliography.mod kinds.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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod glbopt_input.mod cp_output_handling.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="\"Thu Oct 7 18:04:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod glbopt_input.mod cp_output_handling.mod 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_negf.mod' due to: input_cp2k_negf.o true /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: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="\"Thu Oct 7 18:04:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod tmc_stati.mod bibliography.mod kinds.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="\"Thu Oct 7 18:04:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod tmc_stati.mod bibliography.mod kinds.mod input_cp2k_mm.mod 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 '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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod input_cp2k_motion_print.mod cp_units.mod input_cp2k_thermostats.mod input_cp2k_md.mod cp_output_handling.mod input_cp2k_tmc.mod kinds.mod input_cp2k_constraints.mod bibliography.mod input_cp2k_free_energy.mod input_cp2k_subsys.mod input_cp2k_neb.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="\"Thu Oct 7 18:04:01 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_val_types.mod input_section_types.mod input_keyword_types.mod base_hooks.mod string_utilities.mod input_constants.mod input_cp2k_motion_print.mod cp_units.mod input_cp2k_thermostats.mod input_cp2k_md.mod cp_output_handling.mod input_cp2k_tmc.mod kinds.mod input_cp2k_constraints.mod bibliography.mod input_cp2k_free_energy.mod input_cp2k_subsys.mod input_cp2k_neb.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_keyword_types.mod input_val_types.mod input_section_types.mod base_hooks.mod input_cp2k_force_eval.mod string_utilities.mod cp_eri_mme_interface.mod kinds.mod input_cp2k_rsgrid.mod input_constants.mod pw_grids.mod input_cp2k_global.mod input_cp2k_vib.mod swarm_input.mod input_optimize_input.mod input_optimize_basis.mod input_cp2k_negf.mod cp_output_handling.mod input_cp2k_atom.mod input_cp2k_motion.mod shg_integrals_test.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="\"Thu Oct 7 18:04:06 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_keyword_types.mod input_val_types.mod input_section_types.mod base_hooks.mod input_cp2k_force_eval.mod string_utilities.mod cp_eri_mme_interface.mod kinds.mod input_cp2k_rsgrid.mod input_constants.mod pw_grids.mod input_cp2k_global.mod input_cp2k_vib.mod swarm_input.mod input_optimize_input.mod input_optimize_basis.mod input_cp2k_negf.mod cp_output_handling.mod input_cp2k_atom.mod input_cp2k_motion.mod shg_integrals_test.mod 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 '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="\"Thu Oct 7 18:04:08 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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="\"Thu Oct 7 18:04:09 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cell_types.mod cp_para_types.mod tmc_move_types.mod tmc_tree_types.mod parallel_rng_types.mod base_hooks.mod cp_para_env.mod tmc_stati.mod kinds.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="\"Thu Oct 7 18:04:09 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cell_types.mod cp_para_types.mod tmc_move_types.mod tmc_tree_types.mod parallel_rng_types.mod base_hooks.mod cp_para_env.mod tmc_stati.mod kinds.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 cell_types.mod tmc_tree_types.mod tmc_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="\"Thu Oct 7 18:04:10 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cell_types.mod tmc_tree_types.mod tmc_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 cell_types.mod tmc_move_types.mod tmc_tree_types.mod parallel_rng_types.mod base_hooks.mod mathconstants.mod cp_log_handling.mod f77_interface.mod tmc_stati.mod kinds.mod physcon.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="\"Thu Oct 7 18:04:10 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cell_types.mod tmc_move_types.mod tmc_tree_types.mod parallel_rng_types.mod base_hooks.mod mathconstants.mod cp_log_handling.mod f77_interface.mod tmc_stati.mod kinds.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_move_types.mod tmc_tree_types.mod tmc_types.mod base_hooks.mod cp_log_handling.mod tmc_stati.mod kinds.mod cp_files.mod physcon.mod tmc_calculations.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="\"Thu Oct 7 18:04:13 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_move_types.mod tmc_tree_types.mod tmc_types.mod base_hooks.mod cp_log_handling.mod tmc_stati.mod kinds.mod cp_files.mod physcon.mod tmc_calculations.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_move_types.mod tmc_tree_types.mod tmc_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="\"Thu Oct 7 18:04:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_move_types.mod tmc_tree_types.mod tmc_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_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 cell_types.mod tmc_move_types.mod tmc_tree_types.mod parallel_rng_types.mod base_hooks.mod mathlib.mod mathconstants.mod cp_log_handling.mod kinds.mod physcon.mod tmc_calculations.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="\"Thu Oct 7 18:04:18 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cell_types.mod tmc_move_types.mod tmc_tree_types.mod parallel_rng_types.mod base_hooks.mod mathlib.mod mathconstants.mod cp_log_handling.mod kinds.mod physcon.mod tmc_calculations.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 input_section_types.mod tmc_move_types.mod tmc_tree_types.mod tmc_types.mod base_hooks.mod string_utilities.mod mathconstants.mod cp_log_handling.mod tmc_stati.mod kinds.mod physcon.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="\"Thu Oct 7 18:04:22 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_section_types.mod tmc_move_types.mod tmc_tree_types.mod tmc_types.mod base_hooks.mod string_utilities.mod mathconstants.mod cp_log_handling.mod tmc_stati.mod kinds.mod physcon.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_tree_types.mod tmc_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="\"Thu Oct 7 18:04:25 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_tree_types.mod tmc_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_tree_types.mod tmc_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="\"Thu Oct 7 18:04:26 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_tree_types.mod tmc_types.mod base_hooks.mod cp_log_handling.mod tmc_cancelation.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_tree_types.mod tmc_types.mod base_hooks.mod cp_log_handling.mod tmc_stati.mod tmc_tree_references.mod kinds.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="\"Thu Oct 7 18:04:27 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_tree_types.mod tmc_types.mod base_hooks.mod cp_log_handling.mod tmc_stati.mod tmc_tree_references.mod kinds.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_move_types.mod tmc_tree_types.mod tmc_types.mod base_hooks.mod cp_log_handling.mod tmc_moves.mod tmc_move_handle.mod tmc_tree_search.mod tmc_stati.mod tmc_file_io.mod tmc_tree_references.mod kinds.mod tmc_dot_tree.mod tmc_calculations.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="\"Thu Oct 7 18:04:29 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_move_types.mod tmc_tree_types.mod tmc_types.mod base_hooks.mod cp_log_handling.mod tmc_moves.mod tmc_move_handle.mod tmc_tree_search.mod tmc_stati.mod tmc_file_io.mod tmc_tree_references.mod kinds.mod tmc_dot_tree.mod tmc_calculations.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_move_types.mod tmc_tree_types.mod tmc_types.mod base_hooks.mod tmc_tree_build.mod cp_log_handling.mod tmc_move_handle.mod tmc_tree_search.mod tmc_stati.mod tmc_file_io.mod kinds.mod tmc_dot_tree.mod physcon.mod tmc_calculations.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="\"Thu Oct 7 18:04:33 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_move_types.mod tmc_tree_types.mod tmc_types.mod base_hooks.mod tmc_tree_build.mod cp_log_handling.mod tmc_move_handle.mod tmc_tree_search.mod tmc_stati.mod tmc_file_io.mod kinds.mod tmc_dot_tree.mod physcon.mod tmc_calculations.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 cp_para_types.mod tmc_tree_types.mod tmc_types.mod base_hooks.mod tmc_tree_build.mod cp_log_handling.mod message_passing.mod tmc_move_handle.mod tmc_stati.mod kinds.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="\"Thu Oct 7 18:04:36 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_para_types.mod tmc_tree_types.mod tmc_types.mod base_hooks.mod tmc_tree_build.mod cp_log_handling.mod message_passing.mod tmc_move_handle.mod tmc_stati.mod kinds.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 cell_types.mod cp_para_types.mod global_types.mod tmc_tree_types.mod tmc_types.mod base_hooks.mod tmc_file_io.mod kinds.mod tmc_dot_tree.mod tmc_tree_build.mod cp_log_handling.mod tmc_move_handle.mod tmc_cancelation.mod tmc_tree_acceptance.mod tmc_calculations.mod machine.mod tmc_messages.mod tmc_tree_search.mod tmc_stati.mod cp_external_control.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="\"Thu Oct 7 18:04:42 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cell_types.mod cp_para_types.mod global_types.mod tmc_tree_types.mod tmc_types.mod base_hooks.mod tmc_file_io.mod kinds.mod tmc_dot_tree.mod tmc_tree_build.mod cp_log_handling.mod tmc_move_handle.mod tmc_cancelation.mod tmc_tree_acceptance.mod tmc_calculations.mod machine.mod tmc_messages.mod tmc_tree_search.mod tmc_stati.mod cp_external_control.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 cell_types.mod tmc_analysis_types.mod input_section_types.mod tmc_tree_types.mod tmc_types.mod base_hooks.mod mathlib.mod tmc_tree_build.mod mathconstants.mod cp_log_handling.mod tmc_stati.mod tmc_file_io.mod tmc_calculations.mod kinds.mod cp_files.mod physcon.mod force_fields_input.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="\"Thu Oct 7 18:04:46 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cell_types.mod tmc_analysis_types.mod input_section_types.mod tmc_tree_types.mod tmc_types.mod base_hooks.mod mathlib.mod tmc_tree_build.mod mathconstants.mod cp_log_handling.mod tmc_stati.mod tmc_file_io.mod tmc_calculations.mod kinds.mod cp_files.mod physcon.mod force_fields_input.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 cell_types.mod tmc_analysis_types.mod cp_para_types.mod force_env_types.mod tmc_move_types.mod molecule_list_types.mod cp_subsys_types.mod tmc_tree_types.mod tmc_types.mod particle_list_types.mod cp_result_types.mod base_hooks.mod tmc_moves.mod kinds.mod tmc_tree_build.mod cp_log_handling.mod tmc_move_handle.mod tmc_tree_acceptance.mod cp_result_methods.mod tmc_calculations.mod tmc_analysis.mod tmc_messages.mod f77_interface.mod tmc_stati.mod cp_external_control.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="\"Thu Oct 7 18:04:51 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cell_types.mod tmc_analysis_types.mod cp_para_types.mod force_env_types.mod tmc_move_types.mod molecule_list_types.mod cp_subsys_types.mod tmc_tree_types.mod tmc_types.mod particle_list_types.mod cp_result_types.mod base_hooks.mod tmc_moves.mod kinds.mod tmc_tree_build.mod cp_log_handling.mod tmc_move_handle.mod tmc_tree_acceptance.mod cp_result_methods.mod tmc_calculations.mod tmc_analysis.mod tmc_messages.mod f77_interface.mod tmc_stati.mod cp_external_control.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_analysis_types.mod cp_para_types.mod parallel_rng_types.mod global_types.mod tmc_tree_types.mod tmc_types.mod input_section_types.mod base_hooks.mod environment.mod tmc_master.mod tmc_file_io.mod kinds.mod cp_files.mod header.mod tmc_tree_build.mod cp_log_handling.mod tmc_worker.mod message_passing.mod tmc_move_handle.mod bibliography.mod physcon.mod cp_para_env.mod tmc_analysis.mod machine.mod f77_interface.mod tmc_stati.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="\"Thu Oct 7 18:04:55 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_analysis_types.mod cp_para_types.mod parallel_rng_types.mod global_types.mod tmc_tree_types.mod tmc_types.mod input_section_types.mod base_hooks.mod environment.mod tmc_master.mod tmc_file_io.mod kinds.mod cp_files.mod header.mod tmc_tree_build.mod cp_log_handling.mod tmc_worker.mod message_passing.mod tmc_move_handle.mod bibliography.mod physcon.mod cp_para_env.mod tmc_analysis.mod machine.mod f77_interface.mod tmc_stati.mod 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:541: update target 'qs_tddfpt_module.mod' due to: qs_tddfpt_module.o 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 'ipi_driver.mod' due to: ipi_driver.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 '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="\"Thu Oct 7 18:04:59 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 message_passing.mod kinds.mod cp_parser_methods.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="\"Thu Oct 7 18:05:00 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 message_passing.mod kinds.mod cp_parser_methods.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 particle_types.mod input_section_types.mod parallel_rng_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod glbopt_history.mod cp_units.mod particle_methods.mod cp_output_handling.mod swarm_message.mod kinds.mod physcon.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="\"Thu Oct 7 18:05:03 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod input_section_types.mod parallel_rng_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod glbopt_history.mod cp_units.mod particle_methods.mod cp_output_handling.mod swarm_message.mod kinds.mod physcon.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 glbopt_history.mod swarm_message.mod bibliography.mod kinds.mod physcon.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="\"Thu Oct 7 18:05:04 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 glbopt_history.mod swarm_message.mod bibliography.mod kinds.mod physcon.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 particle_types.mod atomic_kind_types.mod molecule_types.mod exclusion_types.mod cp_para_types.mod colvar_types.mod molecule_kind_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod glbopt_mincrawl.mod swarm_message.mod topology.mod cp_output_handling.mod glbopt_minhop.mod cp_units.mod particle_methods.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="\"Thu Oct 7 18:05:06 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod atomic_kind_types.mod molecule_types.mod exclusion_types.mod cp_para_types.mod colvar_types.mod molecule_kind_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod cp_log_handling.mod glbopt_mincrawl.mod swarm_message.mod topology.mod cp_output_handling.mod glbopt_minhop.mod cp_units.mod particle_methods.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 global_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod glbopt_master.mod cp_output_handling.mod swarm_message.mod cp_external_control.mod kinds.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="\"Thu Oct 7 18:05:07 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 global_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod input_constants.mod cp_log_handling.mod glbopt_master.mod cp_output_handling.mod swarm_message.mod cp_external_control.mod kinds.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 global_types.mod force_env_types.mod mdctrl_types.mod cp_para_types.mod input_section_types.mod cp_subsys_types.mod base_hooks.mod f77_interface.mod md_run.mod swarm_message.mod geo_opt.mod kinds.mod physcon.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="\"Thu Oct 7 18:05:08 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 global_types.mod force_env_types.mod mdctrl_types.mod cp_para_types.mod input_section_types.mod cp_subsys_types.mod base_hooks.mod f77_interface.mod md_run.mod swarm_message.mod geo_opt.mod kinds.mod physcon.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 input_constants.mod cp_log_handling.mod glbopt_worker.mod cp_output_handling.mod swarm_message.mod kinds.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="\"Thu Oct 7 18:05:11 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_constants.mod cp_log_handling.mod glbopt_worker.mod cp_output_handling.mod swarm_message.mod kinds.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_iter_types.mod cp_para_types.mod input_section_types.mod base_hooks.mod machine.mod cp_log_handling.mod message_passing.mod swarm_message.mod kinds.mod cp_files.mod cp_para_env.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="\"Thu Oct 7 18:05:12 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_iter_types.mod cp_para_types.mod input_section_types.mod base_hooks.mod machine.mod cp_log_handling.mod message_passing.mod swarm_message.mod kinds.mod cp_files.mod cp_para_env.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 global_types.mod input_section_types.mod cp_para_types.mod base_hooks.mod cp_log_handling.mod cp_output_handling.mod swarm_master.mod swarm_message.mod swarm_worker.mod swarm_mpi.mod kinds.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="\"Thu Oct 7 18:05:13 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 global_types.mod input_section_types.mod cp_para_types.mod base_hooks.mod cp_log_handling.mod cp_output_handling.mod swarm_master.mod swarm_message.mod swarm_worker.mod swarm_mpi.mod kinds.mod 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 'negf_methods.mod' due to: negf_methods.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 '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:541: update target 'farming_methods.mod' due to: farming_methods.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 atomic_kind_types.mod cell_types.mod cp_para_types.mod force_env_types.mod global_types.mod molecule_kind_types.mod molecule_kind_list_types.mod fist_environment_types.mod fist_nonbond_env_types.mod cp_subsys_types.mod particle_list_types.mod input_section_types.mod pair_potential_types.mod base_hooks.mod string_utilities.mod kinds.mod cp_files.mod input_constants.mod cp_log_handling.mod physcon.mod mathconstants.mod cp_units.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="\"Thu Oct 7 18:05:14 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 atomic_kind_types.mod cell_types.mod cp_para_types.mod force_env_types.mod global_types.mod molecule_kind_types.mod molecule_kind_list_types.mod fist_environment_types.mod fist_nonbond_env_types.mod cp_subsys_types.mod particle_list_types.mod input_section_types.mod pair_potential_types.mod base_hooks.mod string_utilities.mod kinds.mod cp_files.mod input_constants.mod cp_log_handling.mod physcon.mod mathconstants.mod cp_units.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 force_env_types.mod mc_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="\"Thu Oct 7 18:05:19 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 force_env_types.mod mc_types.mod base_hooks.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 mathconstants.mod kinds.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="\"Thu Oct 7 18:05:21 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mathconstants.mod kinds.mod physcon.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 mc_types.mod force_env_types.mod base_hooks.mod mathconstants.mod kinds.mod cp_files.mod physcon.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="\"Thu Oct 7 18:05:23 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mc_types.mod force_env_types.mod base_hooks.mod mathconstants.mod kinds.mod cp_files.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 particle_types.mod mc_types.mod atomic_kind_types.mod thermostat_types.mod molecule_types.mod cell_types.mod reftraj_types.mod mc_environment_types.mod thermal_region_types.mod cp_para_types.mod force_env_types.mod metadynamics_types.mod parallel_rng_types.mod colvar_types.mod global_types.mod molecule_kind_types.mod virial_types.mod molecule_kind_list_types.mod md_environment_types.mod md_ener_types.mod atomic_kind_list_types.mod barostat_types.mod distribution_1d_types.mod qs_environment_types.mod cp_subsys_types.mod averages_types.mod molecule_list_types.mod particle_list_types.mod free_energy_types.mod input_section_types.mod simpar_types.mod base_hooks.mod string_utilities.mod md_energies.mod virial_methods.mod wiener_process.mod kinds.mod input_cp2k_check.mod qmmm_util.mod input_constants.mod cp_log_handling.mod bibliography.mod qs_scf_post_gpw.mod input_cp2k_restarts.mod thermostat_methods.mod physcon.mod simpar_methods.mod force_env_methods.mod cp_output_handling.mod mc_move_control.mod reftraj_util.mod thermal_region_utils.mod machine.mod reference_manager.mod cp_units.mod md_run.mod colvar_methods.mod constraint_fxd.mod cp_external_control.mod mc_misc.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="\"Thu Oct 7 18:05:24 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 particle_types.mod mc_types.mod atomic_kind_types.mod thermostat_types.mod molecule_types.mod cell_types.mod reftraj_types.mod mc_environment_types.mod thermal_region_types.mod cp_para_types.mod force_env_types.mod metadynamics_types.mod parallel_rng_types.mod colvar_types.mod global_types.mod molecule_kind_types.mod virial_types.mod molecule_kind_list_types.mod md_environment_types.mod md_ener_types.mod atomic_kind_list_types.mod barostat_types.mod distribution_1d_types.mod qs_environment_types.mod cp_subsys_types.mod averages_types.mod molecule_list_types.mod particle_list_types.mod free_energy_types.mod input_section_types.mod simpar_types.mod base_hooks.mod string_utilities.mod md_energies.mod virial_methods.mod wiener_process.mod kinds.mod input_cp2k_check.mod qmmm_util.mod input_constants.mod cp_log_handling.mod bibliography.mod qs_scf_post_gpw.mod input_cp2k_restarts.mod thermostat_methods.mod physcon.mod simpar_methods.mod force_env_methods.mod cp_output_handling.mod mc_move_control.mod reftraj_util.mod thermal_region_utils.mod machine.mod reference_manager.mod cp_units.mod md_run.mod colvar_methods.mod constraint_fxd.mod cp_external_control.mod mc_misc.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 mc_types.mod particle_list_types.mod molecule_types.mod cell_types.mod force_env_types.mod parallel_rng_types.mod cp_subsys_types.mod force_env_methods.mod base_hooks.mod mathconstants.mod message_passing.mod kinds.mod physcon.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="\"Thu Oct 7 18:05:32 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mc_types.mod particle_list_types.mod molecule_types.mod cell_types.mod force_env_types.mod parallel_rng_types.mod cp_subsys_types.mod force_env_methods.mod base_hooks.mod mathconstants.mod message_passing.mod kinds.mod physcon.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 mc_types.mod atomic_kind_types.mod cell_types.mod cp_para_types.mod force_env_types.mod parallel_rng_types.mod global_types.mod molecule_kind_types.mod molecule_kind_list_types.mod cp_subsys_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_files.mod cp_log_handling.mod message_passing.mod physcon.mod f77_interface.mod mc_misc.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="\"Thu Oct 7 18:05:36 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mc_types.mod atomic_kind_types.mod cell_types.mod cp_para_types.mod force_env_types.mod parallel_rng_types.mod global_types.mod molecule_kind_types.mod molecule_kind_list_types.mod cp_subsys_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_files.mod cp_log_handling.mod message_passing.mod physcon.mod f77_interface.mod mc_misc.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 cp_para_types.mod force_env_types.mod parallel_rng_types.mod cp_subsys_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod mc_coordinates.mod message_passing.mod mc_control.mod physcon.mod force_env_methods.mod mc_move_control.mod particle_methods.mod mc_misc.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="\"Thu Oct 7 18:05:38 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp_para_types.mod force_env_types.mod parallel_rng_types.mod cp_subsys_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod kinds.mod input_constants.mod mc_coordinates.mod message_passing.mod mc_control.mod physcon.mod force_env_methods.mod mc_move_control.mod particle_methods.mod mc_misc.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 mc_types.mod atomic_kind_types.mod cell_types.mod force_env_types.mod parallel_rng_types.mod global_types.mod molecule_kind_types.mod molecule_kind_list_types.mod cp_subsys_types.mod particle_list_types.mod base_hooks.mod kinds.mod cp_log_handling.mod mc_coordinates.mod message_passing.mod physcon.mod force_env_methods.mod mathconstants.mod md_run.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="\"Thu Oct 7 18:05:47 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mc_types.mod atomic_kind_types.mod cell_types.mod force_env_types.mod parallel_rng_types.mod global_types.mod molecule_kind_types.mod molecule_kind_list_types.mod cp_subsys_types.mod particle_list_types.mod base_hooks.mod kinds.mod cp_log_handling.mod mc_coordinates.mod message_passing.mod physcon.mod force_env_methods.mod mathconstants.mod md_run.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 mc_environment_types.mod cp_para_types.mod force_env_types.mod parallel_rng_types.mod global_types.mod cp_subsys_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_files.mod input_constants.mod cp_log_handling.mod mc_coordinates.mod message_passing.mod mc_control.mod mc_ge_moves.mod physcon.mod force_env_methods.mod mathconstants.mod mc_moves.mod mc_move_control.mod machine.mod cp_units.mod particle_methods.mod cp_external_control.mod mc_misc.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="\"Thu Oct 7 18:05:54 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 mc_environment_types.mod cp_para_types.mod force_env_types.mod parallel_rng_types.mod global_types.mod cp_subsys_types.mod particle_list_types.mod input_section_types.mod base_hooks.mod kinds.mod cp_files.mod input_constants.mod cp_log_handling.mod mc_coordinates.mod message_passing.mod mc_control.mod mc_ge_moves.mod physcon.mod force_env_methods.mod mathconstants.mod mc_moves.mod mc_move_control.mod machine.mod cp_units.mod particle_methods.mod cp_external_control.mod mc_misc.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 global_types.mod mc_types.mod mc_environment_types.mod input_section_types.mod cp_para_types.mod force_env_types.mod parallel_rng_types.mod base_hooks.mod cp_log_handling.mod mc_ensembles.mod mc_control.mod kinds.mod physcon.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="\"Thu Oct 7 18:06:03 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 global_types.mod mc_types.mod mc_environment_types.mod input_section_types.mod cp_para_types.mod force_env_types.mod parallel_rng_types.mod base_hooks.mod cp_log_handling.mod mc_ensembles.mod mc_control.mod kinds.mod physcon.mod 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 'pint_methods.mod' due to: pint_methods.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: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 farming_types.mod cp_control_types.mod cp_para_types.mod force_env_types.mod input_keyword_types.mod global_types.mod qs_environment_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod environment.mod string_utilities.mod input_cp2k_read.mod input_cp2k.mod vibrational_analysis.mod tmc_setup.mod kinds.mod cp_files.mod bsse.mod cp_parser_methods.mod grid_api.mod input_cp2k_check.mod input_constants.mod cp_log_handling.mod message_passing.mod qs_tddfpt_module.mod atom.mod input_cp2k_global.mod ipi_driver.mod bibliography.mod sirius_interface.mod cp2k_info.mod rt_propagation.mod cuda_profiling.mod cp_dbcsr_cp2k_link.mod force_env_methods.mod qs_linres_module.mod cp_output_handling.mod optimize_basis.mod swarm.mod optimize_input.mod cp_para_env.mod input_parsing.mod negf_methods.mod pw_fpga.mod machine.mod cell_opt.mod library_tests.mod mscfg_methods.mod farming_methods.mod cp_units.mod f77_interface.mod reference_manager.mod tamc_run.mod md_run.mod geo_opt.mod mc_run.mod neb_methods.mod pint_methods.mod pw_cuda.mod cp2k_debug.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="\"Thu Oct 7 18:06:05 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 farming_types.mod cp_control_types.mod cp_para_types.mod force_env_types.mod input_keyword_types.mod global_types.mod qs_environment_types.mod input_section_types.mod cp_parser_types.mod base_hooks.mod environment.mod string_utilities.mod input_cp2k_read.mod input_cp2k.mod vibrational_analysis.mod tmc_setup.mod kinds.mod cp_files.mod bsse.mod cp_parser_methods.mod grid_api.mod input_cp2k_check.mod input_constants.mod cp_log_handling.mod message_passing.mod qs_tddfpt_module.mod atom.mod input_cp2k_global.mod ipi_driver.mod bibliography.mod sirius_interface.mod cp2k_info.mod rt_propagation.mod cuda_profiling.mod cp_dbcsr_cp2k_link.mod force_env_methods.mod qs_linres_module.mod cp_output_handling.mod optimize_basis.mod swarm.mod optimize_input.mod cp_para_env.mod input_parsing.mod negf_methods.mod pw_fpga.mod machine.mod cell_opt.mod library_tests.mod mscfg_methods.mod farming_methods.mod cp_units.mod f77_interface.mod reference_manager.mod tamc_run.mod md_run.mod geo_opt.mod mc_run.mod neb_methods.mod pint_methods.mod pw_cuda.mod cp2k_debug.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 cp2k_runs.mod base_hooks.mod string_utilities.mod input_constants.mod cp_log_handling.mod machine.mod message_passing.mod f77_interface.mod input_cp2k_read.mod kinds.mod cp_files.mod cp2k_info.mod physcon.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="\"Thu Oct 7 18:06:12 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 cp2k_runs.mod base_hooks.mod string_utilities.mod input_constants.mod cp_log_handling.mod machine.mod message_passing.mod f77_interface.mod input_cp2k_read.mod kinds.mod cp_files.mod cp2k_info.mod physcon.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 cp2k_runs.mod base_hooks.mod input_constants.mod machine.mod cp2k_shell.mod f77_interface.mod input_cp2k.mod kinds.mod cp2k_info.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="\"Thu Oct 7 18:06:15 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 input_section_types.mod qs_active_space_types.mod qs_environment_types.mod cp_fm_types.mod force_env_types.mod qs_mo_types.mod cp2k_runs.mod base_hooks.mod f77_interface.mod input_cp2k_read.mod kinds.mod input_cp2k.mod cp2k_info.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="\"Thu Oct 7 18:06:16 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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: cp2k_runs.o libcp2k.o cp2k_shell.o input_cp2k_motion.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 cp2k_runs.o libcp2k.o cp2k_shell.o input_cp2k_motion.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_types.o mc_moves.o mc_coordinates.o mc_misc.o mc_ge_moves.o mc_run.o mc_ensembles.o mc_environment_types.o mc_move_control.o mc_control.o tamc_run.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_types.o mc_moves.o mc_coordinates.o mc_misc.o mc_ge_moves.o mc_run.o mc_ensembles.o mc_environment_types.o mc_move_control.o mc_control.o tamc_run.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_minhop.o glbopt_master.o glbopt_mincrawl.o glbopt_worker.o swarm.o swarm_message.o glbopt_history.o swarm_mpi.o swarm_worker.o glbopt_input.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_minhop.o glbopt_master.o glbopt_mincrawl.o glbopt_worker.o swarm.o swarm_message.o glbopt_history.o swarm_mpi.o swarm_worker.o glbopt_input.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="\"Thu Oct 7 18:06:21 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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_utils.o tmc_tree_types.o tmc_messages.o tmc_calculations.o tmc_setup.o tmc_analysis_types.o tmc_worker.o tmc_types.o tmc_tree_search.o tmc_move_types.o tmc_cancelation.o tmc_master.o tmc_move_handle.o tmc_stati.o tmc_file_io.o tmc_moves.o tmc_dot_tree.o tmc_analysis.o tmc_tree_references.o tmc_tree_build.o tmc_tree_acceptance.o input_cp2k_tmc.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_utils.o tmc_tree_types.o tmc_messages.o tmc_calculations.o tmc_setup.o tmc_analysis_types.o tmc_worker.o tmc_types.o tmc_tree_search.o tmc_move_types.o tmc_cancelation.o tmc_master.o tmc_move_handle.o tmc_stati.o tmc_file_io.o tmc_moves.o tmc_dot_tree.o tmc_analysis.o tmc_tree_references.o tmc_tree_build.o tmc_tree_acceptance.o input_cp2k_tmc.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:139: 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="\"Thu Oct 7 18:06:22 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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:151: 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="\"Thu Oct 7 18:06:27 UTC 2021\"" -D__COMPILE_HOST="\"41df2f4b97a7\"" -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 Thu Oct 7 18:07:11 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-2021-10-07_18-07-11/summary.txt regtesting location error_summary file: /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/error_summary regtesting location memory_summary file: /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/memory_summary regtesting location output dir: /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11 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 128436 128436 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 (0x00007fffc26df000) liblapack.so.3 => /usr/lib/x86_64-linux-gnu/liblapack.so.3 (0x00007f5a33391000) libblas.so.3 => /usr/lib/x86_64-linux-gnu/libblas.so.3 (0x00007f5a33324000) libfftw3.so.3 => /usr/lib/x86_64-linux-gnu/libfftw3.so.3 (0x00007f5a3311d000) libfftw3_threads.so.3 => /usr/lib/x86_64-linux-gnu/libfftw3_threads.so.3 (0x00007f5a33114000) libint2.so.2 => /usr/lib/x86_64-linux-gnu/libint2.so.2 (0x00007f5a30e8a000) libxcf03.so.5 => /usr/lib/x86_64-linux-gnu/libxcf03.so.5 (0x00007f5a30e81000) libsymspg.so.1 => /usr/lib/x86_64-linux-gnu/libsymspg.so.1 (0x00007f5a30e2f000) libmpi_mpifh.so.40 => /usr/lib/x86_64-linux-gnu/libmpi_mpifh.so.40 (0x00007f5a30dcb000) libscalapack-openmpi.so.2.1 => /usr/lib/x86_64-linux-gnu/libscalapack-openmpi.so.2.1 (0x00007f5a30823000) libelpa.so.15 => /usr/lib/x86_64-linux-gnu/libelpa.so.15 (0x00007f5a3074a000) libgfortran.so.5 => /usr/lib/x86_64-linux-gnu/libgfortran.so.5 (0x00007f5a30494000) libm.so.6 => /lib/x86_64-linux-gnu/libm.so.6 (0x00007f5a30350000) libmvec.so.1 => /lib/x86_64-linux-gnu/libmvec.so.1 (0x00007f5a30322000) libgomp.so.1 => /usr/lib/x86_64-linux-gnu/libgomp.so.1 (0x00007f5a302e2000) libgcc_s.so.1 => /lib/x86_64-linux-gnu/libgcc_s.so.1 (0x00007f5a302c8000) libpthread.so.0 => /lib/x86_64-linux-gnu/libpthread.so.0 (0x00007f5a302a6000) libc.so.6 => /lib/x86_64-linux-gnu/libc.so.6 (0x00007f5a300e1000) libstdc++.so.6 => /usr/lib/x86_64-linux-gnu/libstdc++.so.6 (0x00007f5a2ff14000) libxc.so.5 => /usr/lib/x86_64-linux-gnu/libxc.so.5 (0x00007f5a2f8c6000) libmpi.so.40 => /usr/lib/x86_64-linux-gnu/libmpi.so.40 (0x00007f5a2f79d000) libopen-pal.so.40 => /usr/lib/x86_64-linux-gnu/libopen-pal.so.40 (0x00007f5a2f6e9000) libquadmath.so.0 => /usr/lib/x86_64-linux-gnu/libquadmath.so.0 (0x00007f5a2f6a0000) /lib64/ld-linux-x86-64.so.2 (0x00007f5a36988000) libdl.so.2 => /lib/x86_64-linux-gnu/libdl.so.2 (0x00007f5a2f698000) libopen-rte.so.40 => /usr/lib/x86_64-linux-gnu/libopen-rte.so.40 (0x00007f5a2f5dc000) libhwloc.so.15 => /usr/lib/x86_64-linux-gnu/libhwloc.so.15 (0x00007f5a2f583000) libutil.so.1 => /lib/x86_64-linux-gnu/libutil.so.1 (0x00007f5a2f57e000) libevent_core-2.1.so.7 => /usr/lib/x86_64-linux-gnu/libevent_core-2.1.so.7 (0x00007f5a2f544000) libevent_pthreads-2.1.so.7 => /usr/lib/x86_64-linux-gnu/libevent_pthreads-2.1.so.7 (0x00007f5a2f53f000) libz.so.1 => /lib/x86_64-linux-gnu/libz.so.1 (0x00007f5a2f520000) libudev.so.1 => /usr/lib/x86_64-linux-gnu/libudev.so.1 (0x00007f5a2f4f8000) -------------------------------------------------------------------------- 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-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-mp2-grad H2O_grad_mme.inp -16.766973159454103 OK ( 30.03 sec) H2O_grad_gpw.inp -16.990049885808240 OK ( 30.79 sec) H2_H2_no_freeHFX.inp -2.307711033963850 OK ( 17.78 sec) O2_dyn.inp -31.519148246527706 OK ( 18.07 sec) O2_dyn_mme.inp 0.50585576 OK ( 25.79 sec) CH_dyn_screen.inp -5.700371305120930 OK ( 20.68 sec) MOM_MP2_geoopt.inp -13.969021596403845 OK ( 26.91 sec) H2O_MD_mme.inp -17.056807611801169 OK ( 42.73 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-mp2-grad (1 of 45) done in 221.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-ri-rpa RI_RPA_H2O.inp -17.145691221375809 OK ( 19.36 sec) RI_RPA_H2O_overlap_metric.inp -17.145538849243845 OK ( 17.39 sec) RI_RPA_CH3.inp -7.415612316029154 OK ( 26.66 sec) RI_RPA_H2O_SYRK.inp -17.145691221375809 OK ( 19.66 sec) RI_RPA_minimax_H_atom.inp -0.510122901484671 OK ( 9.66 sec) RI_RPA_H2O_minimax.inp -17.145691263471011 OK ( 19.53 sec) RI_RPA_H2O_PBE0.inp -17.122863632433308 OK ( 20.52 sec) RI_RPA_H2O_PBE0_ADMM1.inp -17.125217824055330 OK ( 30.05 sec) RI_RPA_H2O_Obara_Saika.inp -17.160204463747110 OK ( 9.41 sec) RI_RPA_H2O_svd.inp -17.145632690184613 OK ( 18.49 sec) RI_RPA_H2O_overlap_metric_svd.inp -17.145498315844886 OK ( 16.42 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-ri-rpa (2 of 45) done in 216.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-tddfpt H2O_tddfpt-s-1.inp 0.602948E+00 OK ( 2.87 sec) H2O_tddfpt-t-1.inp 0.304878E+00 OK ( 2.19 sec) NO_tddfpt-s-1.inp 0.348494E+00 OK ( 12.94 sec) NO_tddfpt-t-1.inp 0.359779E+00 OK ( 10.89 sec) H2O_tddfpt-s-2.inp 0.543390E+00 OK ( 2.71 sec) H2O_tddfpt-t-2.inp 0.548605E+00 OK ( 2.60 sec) NO_tddfpt-t-2.inp 0.358683E+00 OK ( 13.82 sec) H2O_tddfpt-s-3.inp 0.543390E+00 OK ( 2.86 sec) H2O_tddfpt-t-3.inp 0.579030E+00 OK ( 3.27 sec) NO_tddfpt-s-3.inp 0.350929E+00 OK ( 7.75 sec) NO_tddfpt-t-3.inp 0.358683E+00 OK ( 13.62 sec) H2O_tddfpt_NTO.inp 0.551476E+00 OK ( 5.39 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-tddfpt (3 of 45) done in 92.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-libxc H2O-hybrid-b3lyp_libxc_uks.inp -76.41035426581183 OK ( 8.52 sec) H2O_pbe_libxc_tddfpt-s.inp -17.23116251470411 OK ( 7.70 sec) H2O_lda_libxc_tddfpt-s.inp -17.13289833455466 OK ( 7.72 sec) H2O_pbe_libxc_tddfpt-t_uks.inp -17.23116251474723 OK ( 17.98 sec) H2O-hybrid-b3lyp_libxc.inp -76.41035426581185 OK ( 6.47 sec) H2O-hybrid-tpssh_libxc.inp -76.40918264715266 OK ( 8.08 sec) H2O_lda_libxc_tddfpt-t_uks.inp -17.13289833455855 OK ( 15.40 sec) H2O-tpssx_libxc.inp -33.88300963208440 OK ( 7.09 sec) diamond_br89_libxc_uks.inp -11.06581614908316 OK ( 79.07 sec) diamond_br89_libxc.inp -11.06581614908316 OK ( 40.67 sec) H2O-tpss_lsd.inp -34.34060245665611 OK ( 21.41 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-libxc (4 of 45) done in 230.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-hfx-periodic H2O-trunc-2.inp -75.99943504501113 OK ( 5.00 sec) H2O-trunc-auto.inp -75.99943504501114 OK ( 5.67 sec) H2O-coul-0.inp -76.02314790926960 OK ( 4.14 sec) H2O-trunc-auto-md.inp -0.752385976642E+02 OK ( 8.26 sec) CH3-trunc-auto.inp -39.13005530688503 OK ( 7.38 sec) CH3-trunc-1.inp -39.36116309682869 OK ( 9.56 sec) CH3-trunc-auto-md.inp -0.387264301986E+02 OK ( 17.52 sec) CH3-coul-0.inp -39.39910229689072 OK ( 8.72 sec) h2o-respa.inp -76.02310918726108 OK ( 42.98 sec) h2o-respa_restart.inp -76.02267217092360 OK ( 31.06 sec) H2O-id-auto.inp -88.00800458675093 OK ( 4.39 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-hfx-periodic (5 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-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-polar h2o_LRraman.inp 0.006125121412 OK ( 2.10 sec) h2o_LRraman_loc.inp 0.009153812508 OK ( 26.92 sec) h2o_LRraman_noort.inp 0.023303680948 OK ( 7.75 sec) H2O_md_polar.inp 0.635317998131 OK ( 65.25 sec) xTB_LRraman.inp 0.804852847403 OK ( 0.30 sec) xTB_LRraman_loc.inp 0.804852847403 OK ( 0.29 sec) h2o_LRraman_LRI.inp 0.004262314774 OK ( 7.18 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-polar (6 of 45) done in 116.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-sccs-2 H2O_sccs_otdiis_cd5.inp -17.22654049703095 OK ( 33.06 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-sccs-2 (7 of 45) done in 35.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/MC/regtest MC_QS.inp -51.34794469 OK ( 6.78 sec) MC_QS_restart.inp -51.34909000 OK ( 8.55 sec) GEMC_NpT_box1.inp 0.49826574 OK ( 2.37 sec) GEMC_NVT_box1.inp 0.49803069 OK ( 2.63 sec) GEMC_swap_box1.inp 0.55872200 OK ( 4.75 sec) canonical.inp 0.55333815 OK ( 0.30 sec) canonical_bias.inp 0.38566238 OK ( 1.18 sec) virial.inp -.723498E+03 OK ( 1.69 sec) hmc.inp -2.49775342 OK ( 30.91 sec) MC_QS_cluster.inp -123.50714373283114 OK ( 66.32 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/MC/regtest (8 of 45) done in 134.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-ps-implicit-2-3 H2O_mixed_periodic_cuboidal.inp -17.23631232134919 OK ( 62.19 sec) H2O_mixed_periodic_cylindrical.inp -17.32193400042425 OK ( 30.54 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-ps-implicit-2-3 (9 of 45) done in 95.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/ATOM/regtest-2 H.inp -0.499999999830 OK ( 0.37 sec) He_1.inp -1.399307796698 OK ( 0.04 sec) He_2.inp -1.336212351224 OK ( 0.02 sec) He_3.inp -1.416270865184 OK ( 0.07 sec) He_5.inp -1.408879880907 OK ( 0.02 sec) F_1.inp -24.171954774816 OK ( 0.16 sec) F_2.inp -24.171954774816 OK ( 0.10 sec) F_3.inp -24.171954774816 OK ( 0.09 sec) F_4.inp -23.517790822115 OK ( 0.05 sec) F_5.inp -23.437623684262 OK ( 0.09 sec) U.inp -25598.253318868839 OK ( 6.77 sec) Ru.inp -15.9518066199 OK ( 8.39 sec) Ru_basis.inp -15.951806619855 OK ( 0.14 sec) Ru_conf.inp -15.9897774741 OK ( 14.45 sec) atom_1.inp -0.462506882641 OK ( 0.05 sec) atom_2.inp -0.356859139125 OK ( 0.11 sec) atom_3.inp -0.462506882641 OK ( 0.08 sec) atom_4.inp -0.146531730136 OK ( 0.12 sec) atom_5.inp -0.462506882641 OK ( 0.07 sec) atom_c1.inp -0.460470116001 OK ( 0.02 sec) atom_c2.inp -0.348633649362 OK ( 0.02 sec) atom_c3.inp -0.460470116001 OK ( 0.02 sec) atom_c4.inp -0.038182392054 OK ( 0.02 sec) atom_c5.inp -0.460470116001 OK ( 0.04 sec) slater_0.inp -2.847630187388 OK ( 0.01 sec) slater_1.inp -526.292493965898 OK ( 0.01 sec) slater_2.inp -24.243036046113 OK ( 0.79 sec) slater_3.inp -2.838751324071 OK ( 0.01 sec) slater_4.inp 8.063992740899 OK ( 0.03 sec) slater_5.inp 109583.1142107928 OK ( 0.07 sec) slater_6.inp 3762956.0625833506 OK ( 0.21 sec) slater_7.inp -2.8616551247 OK ( 0.65 sec) slater_8.inp -0.1875976021 OK ( 0.06 sec) slater_9.inp -525.7615443522 OK ( 0.18 sec) slater_10.inp -2.841058209720 OK ( 0.03 sec) Hg.inp -19601.624766751091 OK ( 3.20 sec) C.inp -37.799871796427 OK ( 0.38 sec) C_ADMM.inp -37.758721798836 OK ( 0.20 sec) C_tpss.inp -37.801438870459 OK ( 0.50 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/ATOM/regtest-2 (10 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-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/LIBTEST test_01.inp - OK ( 6.78 sec) test_02.inp - OK ( 1.37 sec) test_pw.inp - OK ( 0.45 sec) test_pw_02.inp - OK ( 0.01 sec) test_pw_03.inp - OK ( 0.01 sec) test_pw_04.inp - OK ( 14.34 sec) test_pw_05.inp - OK ( 0.01 sec) test_cp_fm_gemm_01.inp - OK ( 2.05 sec) test_cp_fm_gemm_02.inp - OK ( 1.44 sec) eig.inp - OK ( 0.03 sec) dbcsr_mm_blas.inp - OK ( 0.14 sec) dbcsr_multistack.inp - OK ( 0.40 sec) dbcsr_types.inp - OK ( 0.52 sec) dbcsr_blocks_01.inp 20978908949.261906 OK ( 2.41 sec) dbcsr_blocks_02.inp 21229174127.238159 OK ( 2.08 sec) dbcsr_blocks_03.inp 21561533688.640675 OK ( 1.92 sec) dbcsr_blocks_04.inp 21304439095.777740 OK ( 2.77 sec) dbcsr_blocks_05.inp 21455488291.450737 OK ( 2.60 sec) dbcsr_types_01.inp 272584373.29241335 OK ( 0.47 sec) dbcsr_types_02.inp 272584373.29241335 OK ( 0.60 sec) dbcsr_types_03.inp 272584373.29241335 OK ( 0.57 sec) dbcsr_types_04.inp 272584373.29241335 OK ( 0.55 sec) dbcsr_types_05.inp 272584373.29241335 OK ( 0.49 sec) dbcsr_io_1.inp - OK ( 0.45 sec) dbcsr_order_N.inp 1910924.8949438259 OK ( 7.61 sec) test_eri_mme_accuracy.inp - OK ( 2.41 sec) test_eri_mme_accuracy_longrange.inp - OK ( 2.90 sec) test_eri_mme_accuracy_yukawa.inp - OK ( 2.12 sec) test_eri_mme_performance.inp - OK ( 3.19 sec) test_minimax.inp - OK ( 2.01 sec) test_shg_integrals_01.inp - OK ( 3.70 sec) test_shg_integrals_02.inp - OK ( 1.61 sec) grid_ref_backend_ortho.inp -21.04944231395037 OK ( 1.56 sec) grid_validate_ortho.inp -21.04944231395037 OK ( 1.79 sec) grid_ref_backend_nonortho.inp -18.04976254477839 OK ( 0.91 sec) grid_validate_nonortho.inp -18.04976254477839 OK ( 1.39 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/LIBTEST (11 of 45) done in 101.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-hfx-stress ch3-admm.inp -7.17220679295E+00 OK ( 39.19 sec) ch3.inp 2.83902802123E+01 OK ( 15.15 sec) ch4-admm.inp -7.10694854758E+00 OK ( 31.67 sec) h2o.inp 1.26297506368E+01 OK ( 9.34 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-hfx-stress (12 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-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/DFTB/regtest-nonscc ch2o-1.inp -5.82072731467941 OK ( 0.16 sec) ch2o-2.inp -5.82159061359820 OK ( 0.17 sec) ch2o-3.inp -5.81373413468792 OK ( 0.26 sec) ch2o-r.inp -5.81373413468792 OK ( 0.25 sec) h2-1.inp -0.70875565358819 OK ( 0.06 sec) h2-2.inp -0.70875565358819 OK ( 0.02 sec) h2-3.inp -0.70875565358819 OK ( 0.03 sec) h2-4.inp -0.71042952969308 OK ( 0.17 sec) h2o-32_1.inp -131.08636939008764 OK ( 1.75 sec) h2o-32_2.inp -131.07999691054354 OK ( 2.14 sec) h2o-32_3.inp -131.07520911566405 OK ( 1.16 sec) h2o-32_4.inp -131.07520911521181 OK ( 10.03 sec) MoS.inp -2.99616182900092 OK ( 0.38 sec) n2.inp -4.86560729572791 OK ( 1.38 sec) s2.inp -4.83731808711856 OK ( 0.35 sec) ch2o_atprop.inp -5.81281420275335 OK ( 0.09 sec) MoS_atprop.inp -2.99616182900092 OK ( 0.40 sec) h2o-32_atprop.inp -131.08636939008764 OK ( 1.82 sec) co2_1.inp -8.55586246566685 OK ( 0.05 sec) co2_2.inp -8.55586246566686 OK ( 0.05 sec) co2_3.inp -8.55586246566686 OK ( 0.05 sec) si_kp1.inp -10.06358203475393 OK ( 2.08 sec) si_kp2.inp - OK ( 18.54 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/DFTB/regtest-nonscc (13 of 45) done in 61.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-hirshfeld htest_1.inp -17.14603641519600 OK ( 0.96 sec) htest_2.inp -17.14603641519600 OK ( 0.79 sec) htest_3.inp -17.14603641519600 OK ( 0.98 sec) htest_4.inp -17.14603641519601 OK ( 0.66 sec) htest_5.inp -17.14603641519600 OK ( 0.73 sec) htest_6.inp -17.14603641519600 OK ( 1.25 sec) htest_7.inp -17.13771713041175 OK ( 0.97 sec) htest_8.inp -17.13771713041176 OK ( 1.15 sec) htest_9.inp -17.13771713041177 OK ( 1.58 sec) hlsd_1.inp -16.81101156813314 OK ( 1.67 sec) hlsd_2.inp -16.81101156813313 OK ( 2.20 sec) hlsd_3.inp -16.81101156813313 OK ( 1.70 sec) hlsd_4.inp -16.81101156813313 OK ( 1.47 sec) hlsd_5.inp -16.81101156813313 OK ( 1.90 sec) hlsd_6.inp -16.80070757658128 OK ( 2.02 sec) hlsd_7.inp -16.80070757658127 OK ( 1.87 sec) hlsd_8.inp -16.80070757658128 OK ( 2.49 sec) hlsd_9.inp -16.80070757658130 OK ( 2.12 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-hirshfeld (14 of 45) done in 43.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-gpw-2-1 H2-vib.inp 3855.524137 OK ( 15.76 sec) H2-vib_tc.inp -5.75148845 OK ( 16.28 sec) H2O-2.inp -17.14619644944920 OK ( 1.93 sec) H2O-3.inp -17.14553123442905 OK ( 2.05 sec) H2O-4.inp -17.14677584577016 OK ( 2.38 sec) ZrO.inp -62.20520122490161 OK ( 1.05 sec) Ar-12.inp -21.04251999575884 OK ( 2.13 sec) Ar-13.inp -21.12624107439688 OK ( 1.91 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-gpw-2-1 (15 of 45) done in 51.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QMMM/DFTB/regtest wdim_scc.inp -4.07355023693330 OK ( 0.18 sec) wdim_nonscc.inp -4.10498450145550 OK ( 0.16 sec) wdimmc_scc.inp -4.07060757309577 OK ( 0.16 sec) wdimmc_nonscc.inp -4.10169797261566 OK ( 0.11 sec) epc_1.inp -4.07357205844602 OK ( 0.19 sec) epc_2.inp -4.07355023693330 OK ( 0.09 sec) epc_3.inp -4.10500910796087 OK ( 0.21 sec) epc_4.inp -4.07358020377115 OK ( 0.20 sec) fdeb_1.inp - OK ( 2.48 sec) fdeb_2.inp - OK ( 2.87 sec) fdeb_3.inp - OK ( 2.25 sec) fdeb_4.inp - OK ( 3.33 sec) fdeb_5.inp - OK ( 2.14 sec) fdeb_6.inp - OK ( 3.30 sec) fdeb_7.inp - OK ( 4.18 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QMMM/DFTB/regtest (16 of 45) done in 35.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QMMM/QS/regtest-gapw C11H24-qmmmgapwall-gauss-0.inp -156.88271046730762 OK ( 6.38 sec) C11H24-qmmmgapw-gauss-0.inp -28.0421973526 OK ( 6.67 sec) H2O-qmmm-gapw-fdbg.inp -16.93909155475013 OK ( 18.10 sec) H2O-qmmm-hfx.inp -0.176043379384E+02 OK ( 13.08 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QMMM/QS/regtest-gapw (17 of 45) done in 49.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QMMM/QS/regtest-4 crys_per_qmmm.inp -0.08375440741138 OK ( 4.20 sec) crys_per_qmmm_anal.inp -0.03306937253920 OK ( 4.32 sec) crys_per_qmmm_spln.inp -0.03306936689225 OK ( 5.26 sec) crys_per_qmmm_none.inp -0.08375440741158 OK ( 2.56 sec) acn-qmmm-re.inp -14.78512402427976 OK ( 2.09 sec) acn-conn-1.inp -291.98859227612104 OK ( 8.64 sec) wat_nacl.inp -16.691503876245207 OK ( 5.15 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QMMM/QS/regtest-4 (18 of 45) done in 39.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QMMM/SE/regtest_2 nh3_g4x6_excl_mm.inp -0.913069017786E+01 OK ( 1.56 sec) nh3_g4x6_excl_qm.inp -0.913127863162E+01 OK ( 1.98 sec) water_colv_excl_mm.inp -0.128071776255E+02 OK ( 1.75 sec) water_colv_excl_qm.inp -0.128078086386E+02 OK ( 1.64 sec) water_fixd_excl_mm.inp -0.128094856912E+02 OK ( 0.93 sec) water_fixd_excl_qm.inp -0.128087667071E+02 OK ( 1.66 sec) water_g3x3_excl_mm.inp -0.128057061878E+02 OK ( 1.29 sec) water_g3x3_excl_qm.inp -0.128090813557E+02 OK ( 1.69 sec) Si_tersoff_qmmm.inp -3418.06809308977336 OK ( 17.20 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QMMM/SE/regtest_2 (19 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-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-mp2-1 H2O-01.inp -76.263035235006981 OK ( 13.89 sec) Li.inp -7.442887463667537 OK ( 17.67 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-mp2-1 (20 of 45) done in 35.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-gapw-2 Li-ROKS.inp -7.33891040994158 OK ( 3.08 sec) NO2-ROKS.inp -203.77833570926848 OK ( 5.99 sec) C-levelshift.inp -37.44694658478079 OK ( 3.25 sec) H2-pbe-restart-run.inp -0.60698327541572 OK ( 12.16 sec) H2-pbe-restart-rerun.inp -0.60698327541578 OK ( 2.25 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-gapw-2 (21 of 45) done in 31.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QMMM/QS/regtest-2-erf H2O-qmmm-gauss-14-geep-2.inp -12.90417644796132 OK ( 0.38 sec) H2O-qmmm-gauss-14-geep-3.inp -12.90712061195513 OK ( 0.40 sec) H2O-qmmm-gauss-14-geep-4.inp -12.90733560861445 OK ( 0.53 sec) H2O-qmmm-gauss-14-geep-5.inp -12.92642686633616 OK ( 0.45 sec) H2O-qmmm-gauss-14-geep-6.inp -12.92230602229930 OK ( 0.40 sec) H2O-qmmm-gauss-14-geep-7.inp -12.91849696653133 OK ( 0.55 sec) H2O-qmmm-gauss-14-geep-8.inp -12.91621682584141 OK ( 0.58 sec) H2O-qmmm-gauss-14-geep-9.inp -12.91437166178052 OK ( 0.55 sec) H2O-qmmm-gauss-14-geep-10.inp -12.91328069125533 OK ( 0.50 sec) H2O-qmmm-gauss-14-geep-11.inp -12.91297474164520 OK ( 0.57 sec) H2O-qmmm-gauss-14-geep-12.inp -12.91332340554817 OK ( 0.65 sec) H2O-qmmm-gauss-14-geep-13.inp -12.91325023093018 OK ( 0.62 sec) H2O-qmmm-gauss-14-geep-14.inp -12.91299456138502 OK ( 0.77 sec) H2O-qmmm-gauss-14-geep-15.inp -12.91325018773295 OK ( 2.50 sec) H2O-qmmm-gauss-14-geep-16.inp -12.91325925146001 OK ( 2.16 sec) H2O-qmmm-gauss-14-geep-17.inp -12.91336718381622 OK ( 2.36 sec) H2O-qmmm-gauss-14-geep-18.inp -12.91336753630967 OK ( 3.37 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QMMM/QS/regtest-2-erf (22 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-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-md-lgvregion langevin_regions-1.inp -34.28350497030245 OK ( 3.68 sec) langevin_regions-2.inp -34.29678091854983 OK ( 3.51 sec) langevin_regions-3.inp -34.28350497030269 OK ( 3.48 sec) langevin_regions-4.inp -34.28727330165425 OK ( 3.31 sec) langevin_regions-5.inp -34.36743843099378 OK ( 5.79 sec) langevin_regions-6.inp -34.36335813031020 OK ( 4.91 sec) langevin_regions-7.inp -34.37404120268235 OK ( 5.09 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-md-lgvregion (23 of 45) done in 36.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-almo-eda almo-eda-x.inp -85.963743073053323 OK ( 31.69 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-almo-eda (24 of 45) done in 33.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-epr-2 NO2-EPR-1.inp -0.344563E-02 OK ( 18.48 sec) NO2-EPR-2.inp -0.252817E-02 OK ( 6.43 sec) NO2-EPR-3.inp -0.358602E-02 OK ( 7.77 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-epr-2 (25 of 45) done in 36.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-hybrid-1 H2O-hybrid-bhandh.inp -75.90482120088640 OK ( 5.99 sec) H2O-hybrid-bhandhlyp.inp -76.33558053104215 OK ( 5.84 sec) H2O-hybrid-pbe0.inp -76.31995335312718 OK ( 5.81 sec) H2O-hybrid-b3lyp.inp -76.37338940401894 OK ( 6.40 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-hybrid-1 (26 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-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/FARMING/regtest-1 farming-1.inp - OK ( 1.14 sec) farming-2.inp - OK ( 1.26 sec) farming-3.inp - OK ( 1.40 sec) farming-4.inp - OK ( 1.39 sec) farming-5.inp - OK ( 1.60 sec) farming-6.inp - OK ( 1.10 sec) farming-7.inp - OK ( 1.35 sec) farming-8.inp - OK ( 1.60 sec) farming-9.inp - OK ( 0.20 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/FARMING/regtest-1 (27 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-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-ot-refine-3 h2o_ot_lwdn_on_the_fly_l1.inp -17.13045715683765 OK ( 1.01 sec) h2o_ot_poly_on_the_fly_l1.inp -17.13045715683766 OK ( 1.16 sec) o2_ot_lwdn_on_the_fly_l1.inp -31.70815200232903 OK ( 1.73 sec) o2_ot_poly_on_the_fly_l1.inp -31.70815200232898 OK ( 1.64 sec) h2o_ot_refine_3.inp -17.08884672065216 OK ( 0.79 sec) h2o_ot_refine_4.inp -17.11857283464192 OK ( 0.69 sec) o2_ot_refine_3.inp -31.60858514413055 OK ( 1.12 sec) o2_ot_refine_4.inp -31.58768162895353 OK ( 0.92 sec) h2o_ot_precond_1.inp -16.05766867329450 OK ( 0.41 sec) h2o_ot_precond_2.inp -16.06790080254981 OK ( 0.33 sec) h2o_ot_precond_3.inp -16.02559849783376 OK ( 0.36 sec) h2o_ot_precond_4.inp -15.85782186391538 OK ( 0.30 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-ot-refine-3 (28 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-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/Fist/regtest-11 H2O-32_NVT_CSVR_gen1.inp -0.609208076083E+00 OK ( 0.53 sec) H2O-32_NVT_CSVR_gen2.inp -0.532133592588E+00 OK ( 0.45 sec) H2O-32_NVT_CSVR_gen3.inp -0.500113893497E+00 OK ( 0.54 sec) H2O-32_NVT_NOSE_gen_noCNS0.inp -0.492823650978E+00 OK ( 0.55 sec) H2O-32_NVT_CSVR_gen_noCNS1.inp -0.509272888286E+00 OK ( 0.46 sec) H2O-32_NVT_CSVR_gen_noCNS1_R.inp -0.458244617541E+00 OK ( 0.38 sec) H2O-32_NVT_CSVR_gen_noCNS2.inp -0.505086327342E+00 OK ( 0.58 sec) H2O-32_NVT_CSVR_gen_noCNS2_R.inp -0.448996689945E+00 OK ( 0.46 sec) H2O-32_NVT_NOSE_gen_noCNS1.inp -0.495791635301E+00 OK ( 0.43 sec) H2O-32_NVT_NOSE_gen_noCNS1_R.inp -0.494111874054E+00 OK ( 0.48 sec) H2O-32_NVT_NOSE_gen_noCNS2.inp -0.484511068410E+00 OK ( 0.60 sec) H2O-32_NVT_NOSE_gen_noCNS2_R.inp -0.470407397710E+00 OK ( 0.42 sec) H2O-32_NVT_CSVR_gen_noCNS3.inp -0.505086327342E+00 OK ( 0.40 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/Fist/regtest-11 (29 of 45) done in 17.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-cdft-3-1 HeH-noconstraint.inp -3.01067446615106 OK ( 4.77 sec) HeH-cdft-state-1.inp 0.048406444567 OK ( 6.38 sec) HeH-cdft-state-2-reversed.inp -1.819391902440 OK ( 6.86 sec) HeH-mixed-cdft-reversed-1.inp 616.641603574982 OK ( 1.67 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-cdft-3-1 (30 of 45) done in 24.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/NEB/regtest-1 2gly_B-NEB.inp -0.25722568775377 OK ( 2.76 sec) 2gly_CI-NEB.inp -0.18925537289823 OK ( 2.60 sec) 2gly_EB-NEB.inp 49.27319370383622 OK ( 2.04 sec) 2gly_IT-NEB.inp 0.38518828458623 OK ( 1.60 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/NEB/regtest-1 (31 of 45) done in 15.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-pao-3 He_ref.inp -2.889334869153417 OK ( 2.38 sec) He_pao_initguess_exp.inp -2.888972913350860 OK ( 1.22 sec) He_pao_initguess_fock.inp -2.888972913350860 OK ( 1.16 sec) He_pao_initguess_rotinv.inp -2.888972913350860 OK ( 1.00 sec) He_pao_initguess_gth.inp -2.888972913350860 OK ( 1.13 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-pao-3 (32 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-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/optimize_input/regtest-1 argon-ref.inp - OK ( 1.84 sec) driver.inp 0.1072347063760515E+03 OK ( 0.85 sec) driver-restart.inp 0.1076965059321591E+03 OK ( 1.32 sec) driver-stride.inp 0.1072343388958498E+03 OK ( 0.33 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/optimize_input/regtest-1 (33 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-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-properties/resp CH3OH_nonperiodic.inp 4.418290 OK ( 1.27 sec) CH3OH_periodic.inp 2.456029 OK ( 0.97 sec) graphite.inp -1.073313 OK ( 3.72 sec) CH3OH_periodic_repeat.inp -4.871712 OK ( 1.04 sec) graphite_REPEAT.inp 0.006058 OK ( 4.59 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-properties/resp (34 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-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-nmr-2 He_nmr_full.inp 0.198893E+03 OK ( 12.31 sec) he2_bug_disp.inp 0.144732E+03 OK ( 3.21 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-nmr-2 (35 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-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/SE/regtest-3-1 H2O-MNDO-2.inp -351.42145109555827 OK ( 0.39 sec) H-0.inp -0.319258384771667 OK ( 0.11 sec) H2-0.inp -0.993280881213762 OK ( 0.36 sec) H2.inp -0.037305167769230 OK ( 0.30 sec) H2O-MNDO.inp -12.913048351744974 OK ( 1.61 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/SE/regtest-3-1 (36 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-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-optbas H2O-ref.inp -17.02896604845323 OK ( 3.74 sec) opt-1.inp -.46916008E+03 OK ( 9.04 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-optbas (37 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-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-linearscaling test-shrt.inp - OK ( 1.26 sec) w3-filter.inp -51.14051793253743 OK ( 2.70 sec) w3-filter-2.inp -78.30555080313486 OK ( 0.86 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-linearscaling (38 of 45) done in 8.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/SWARM/regtest-glbopt-1 LJ10_minhop_1.inp -0.26595092E-01 OK ( 1.01 sec) LJ10_minhop_2.inp -0.28422123E-01 OK ( 0.67 sec) LJ10_mincrawl_1.inp -0.28422122E-01 OK ( 4.35 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/SWARM/regtest-glbopt-1 (39 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-2021-10-07_18-07-11/tests/TAMC/regtest (40 of 45) Running dimer.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/TAMC/regtest dimer.inp -31.336010768917095 OK ( 13.58 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/TAMC/regtest (40 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-2021-10-07_18-07-11/tests/QS/regtest-lsroks (41 of 45) Running O2.inp >>> /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-lsroks O2.inp -31.43642997434301 OK ( 6.26 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-lsroks (41 of 45) done in 8.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QMMM/QS/regtest-lrigpw C11H24-qmmm-gauss-0-lrigpw.inp -28.00745026097763 OK ( 3.60 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QMMM/QS/regtest-lrigpw (42 of 45) done in 5.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/FE/regtest-2 Solv_alch_chng.inp -0.732003926645E+01 OK ( 6.49 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/FE/regtest-2 (43 of 45) done in 8.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-fftw H2-big-1.inp -28.149134408983247 OK ( 3.98 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-fftw (44 of 45) done in 6.00 sec Starting regression tests in /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/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-2021-10-07_18-07-11/tests/QS/regtest-dm-ls-scf-4 H2O-dft-ls-DEFAULTS.inp -17.031737705910469 OK ( 1.57 sec) H2O-dft-ls-NEWTONSCHULZ.inp -17.031737705910469 OK ( 1.75 sec) H2O-dft-ls-PROOT3.inp -17.031737715858103 OK ( 1.66 sec) H2O-dft-ls-PROOT4.inp -17.031737702676047 OK ( 1.29 sec) H2O-dft-ls-PROOT5.inp -17.031737600350329 OK ( 1.49 sec) H2O-dft-ls-NEWTONSCHULZ3.inp -17.031737706154345 OK ( 1.40 sec) H2O-dft-ls-NEWTONSCHULZ4.inp -17.031737706154342 OK ( 1.69 sec) H2O-dft-ls-NEWTONSCHULZ5.inp -17.031737706154345 OK ( 1.61 sec) H2O-dft-ls-NEWTONSCHULZ6.inp -17.031737706154271 OK ( 1.48 sec) H2O-dft-ls-NEWTONSCHULZ7.inp -17.031737706160779 OK ( 1.57 sec) H2O-dft-ls-NEWTONSCHULZ-SYMMETRIC.inp -17.031737705910469 OK ( 1.40 sec) H2O-dft-ls-SUBMATRIX-NS.inp -17.031737705910469 OK ( 1.35 sec) H2O-dft-ls-SUBMATRIX-NS3.inp -17.031737706154345 OK ( 1.66 sec) H2O-dft-ls-SUBMATRIX-DIRECT.inp -17.031737706154338 OK ( 1.48 sec) H2O-dft-ls-SUBMATRIX-DIRECT-MUADJ.inp -17.031737706154342 OK ( 1.56 sec) H2O-dft-ls-SUBMATRIX-DIRECT-MUADJ-LOWMEM.inp -17.031737706154345 OK ( 1.64 sec) <<< /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/tests/QS/regtest-dm-ls-scf-4 (45 of 45) done in 38.00 sec -------------------------------------------------------------------------- -------------------------------------------------------------------------- regtesting location summary file: /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/summary.txt regtesting location error_summary file: /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/error_summary regtesting location memory_summary file: /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11/memory_summary regtesting location output dir: /build/cp2k-Q381vr/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2021-10-07_18-07-11 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=79.07, yerr=0.0 PlotPoint: name="99th_percentile", plot="timings", label="99th %ile", y=49.51139999999952, yerr=0.0 PlotPoint: name="98th_percentile", plot="timings", label="98th %ile", y=37.22840000000004, yerr=0.0 PlotPoint: name="95th_percentile", plot="timings", label="95th %ile", y=26.834999999999997, yerr=0.0 PlotPoint: name="90th_percentile", plot="timings", label="90th %ile", y=17.276000000000007, yerr=0.0 PlotPoint: name="80th_percentile", plot="timings", label="80th %ile", y=7.340000000000002, 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; 39min Status: OK -------------------------------------------------------------------------- Regtest took 2344.00 seconds. -------------------------------------------------------------------------- Thu Oct 7 18:46:14 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-8.1-94y6hgvsu 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.6uujaFFThY... I: success in 7271.6757 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